2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethylphosphonic acid;[2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate;[(2S)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropyl]sulfanylmethylphosphonic acid

C70H108N30O35P6S — CID 160660124

IUPAC2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethylphosphonic acid;[2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate;[(2S)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropyl]sulfanylmethylphosphonic acid
SMILESC=C(COCP(=O)(O)O)Cn1cnc2c(=O)[nH]c(N)nc21.C=C(COCP(=O)(OCOC(=O)OC(C)C)OCOC(=O)OC(C)C)Cn1cnc2c(=O)[nH]c(N)nc21.CC(COCP(=O)(O)O)Cn1cnc2c(=O)[nH]c(N)nc21.C[C@@H](COCP(=O)(O)O)Cn1cnc2c(=O)[nH]c(N)nc21.C[C@@H](CSCP(=O)(O)O)Cn1cnc2c(=O)[nH]c(N)nc21.C[C@H](COCP(=O)(O)O)Cn1cnc2c(=O)[nH]c(N)nc21
InChIInChI=1S/C20H30N5O11P.3C10H16N5O5P.C10H14N5O5P.C10H16N5O4PS/c1-12(2)35-19(27)31-9-33-37(29,34-10-32-20(28)36-13(3)4)11-30-7-14(5)6-25-8-22-15-16(25)23-18(21)24-17(15)26;4*1-6(3-20-5-21(17,18)19)2-15-4-12-7-8(15)13-10(11)14-9(7)16;1-6(3-21-5-20(17,18)19)2-15-4-12-7-8(15)13-10(11)14-9(7)16/h8,12-13H,5-7,9-11H2,1-4H3,(H3,21,23,24,26);3*4,6H,2-3,5H2,1H3,(H2,17,18,19)(H3,11,13,14,16);4H,1-3,5H2,(H2,17,18,19)(H3,11,13,14,16);4,6H,2-3,5H2,1H3,(H2,17,18,19)(H3,11,13,14,16)/t;2*6-;;;6-/m.10..1/s1
InChIKeyRLOFQLAZAPXSFX-QPFXXSLZSA-N
MW2147.72 g/mol
LogP0.58
Rot. Bonds44

About 2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethylphosphonic acid;[2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate;[(2S)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropyl]sulfanylmethylphosphonic acid

2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethylphosphonic acid;[2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate;[(2S)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropyl]sulfanylmethylphosphonic acid (PubChem CID 160660124) has the molecular formula C70H108N30O35P6S and a molecular weight of 2147.72 g/mol. Its IUPAC name is 2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethylphosphonic acid;[2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate;[(2S)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropyl]sulfanylmethylphosphonic acid.

Molecular Properties

Compound Name2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethylphosphonic acid;[2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate;[(2S)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropyl]sulfanylmethylphosphonic acid
PubChem CID160660124
Molecular FormulaC70H108N30O35P6S
Molecular Weight2147.72 g/mol
Exact Mass2146.57
IUPAC Name2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethylphosphonic acid;[2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate;[(2S)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropyl]sulfanylmethylphosphonic acid
SMILESC=C(COCP(=O)(O)O)Cn1cnc2c(=O)[nH]c(N)nc21.C=C(COCP(=O)(OCOC(=O)OC(C)C)OCOC(=O)OC(C)C)Cn1cnc2c(=O)[nH]c(N)nc21.CC(COCP(=O)(O)O)Cn1cnc2c(=O)[nH]c(N)nc21.C[C@@H](COCP(=O)(O)O)Cn1cnc2c(=O)[nH]c(N)nc21.C[C@@H](CSCP(=O)(O)O)Cn1cnc2c(=O)[nH]c(N)nc21.C[C@H](COCP(=O)(O)O)Cn1cnc2c(=O)[nH]c(N)nc21
InChIInChI=1S/C20H30N5O11P.3C10H16N5O5P.C10H14N5O5P.C10H16N5O4PS/c1-12(2)35-19(27)31-9-33-37(29,34-10-32-20(28)36-13(3)4)11-30-7-14(5)6-25-8-22-15-16(25)23-18(21)24-17(15)26;4*1-6(3-20-5-21(17,18)19)2-15-4-12-7-8(15)13-10(11)14-9(7)16;1-6(3-21-5-20(17,18)19)2-15-4-12-7-8(15)13-10(11)14-9(7)16/h8,12-13H,5-7,9-11H2,1-4H3,(H3,21,23,24,26);3*4,6H,2-3,5H2,1H3,(H2,17,18,19)(H3,11,13,14,16);4H,1-3,5H2,(H2,17,18,19)(H3,11,13,14,16);4,6H,2-3,5H2,1H3,(H2,17,18,19)(H3,11,13,14,16)/t;2*6-;;;6-/m.10..1/s1
InChIKeyRLOFQLAZAPXSFX-QPFXXSLZSA-N
XLogP0.58
TPSA977.93 Ų
H-Bond Donors22
H-Bond Acceptors50
Rotatable Bonds44
Heavy Atoms142
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002147.72
LogP ≤ 50.58
H-Bond Donors ≤ 522
H-Bond Acceptors ≤ 1050

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze 2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethylphosphonic acid;[2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate;[(2S)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropyl]sulfanylmethylphosphonic acid with MolForge

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Related Compounds

[(3S)-4-(2-amino-6-oxo-1H-purin-9-yl)-3-methylbutyl]phosphonic acid;2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethylphosphonic acid;[2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate;[(2S)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropyl]sulfanylmethylphosphonic acid
CID 158238317
[(2S)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid
CID 136635852
[3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropyl]sulfanylmethyl-[hydroxy(phosphonooxy)phosphoryl]oxyphosphinic acid
CID 137046969
2-amino-9-[(3R,4S)-4-hydroxy-3-(hydroxymethyl)-2-methylidenecyclopentyl]-1H-purin-6-one;[[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate;carbon dioxide;prop-2-enoic acid;hydrate
CID 176532024
[(2S)-1-(2-amino-6-oxo-1H-purin-9-yl)-3-fluoropropan-2-yl]oxymethylphosphonic acid
CID 135542259
[1-(2-amino-6-oxo-1H-purin-9-yl)-3-hydroxypropan-2-yl]oxymethylphosphonic acid
CID 135524540
[(2R)-1-(2-amino-6-oxo-1H-purin-9-yl)propan-2-yl]oxymethylphosphonic acid;phosphono dihydrogen phosphate
CID 136602085
[(2R)-1-(2-amino-6-oxo-1H-purin-9-yl)propan-2-yl]oxymethylphosphonamidic acid
CID 136928955
[(2S)-1-(2-amino-6-oxo-1H-purin-9-yl)-4-hydroxybutan-2-yl]oxymethylphosphonic acid
CID 135508794
[2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]-3-hydroxypropoxy]methyl-[hydroxy(phosphonooxy)phosphoryl]oxyphosphinic acid;[1-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropan-2-yl]oxymethyl-[hydroxy(phosphonooxy)phosphoryl]oxyphosphinic acid;[(2S)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methyl-[hydroxy(phosphonooxy)phosphoryl]oxyphosphinic acid;[3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methyl-[hydroxy(phosphonooxy)phosphoryl]oxyphosphinic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropyl]sulfanylmethyl-[hydroxy(phosphonooxy)phosphoryl]oxyphosphinic acid;1-(2-amino-6-oxo-1H-purin-9-yl)propan-2-yloxymethyl-[hydroxy(phosphonooxy)phosphoryl]oxyphosphinic acid;2-(2-amino-6-oxo-1H-purin-9-yl)propoxymethyl-[hydroxy(phosphonooxy)phosphoryl]oxyphosphinic acid
CID 157127991
[3-(2-amino-6-chloropurin-9-yl)-2,2-dimethylpropoxy]methylphosphonic acid;2-[(2-amino-6-chloropurin-9-yl)methyl]prop-2-enoxymethylphosphonic acid;[3-(2-amino-6-oxo-1H-purin-9-yl)-2,2-dimethylpropoxy]methylphosphonic acid;2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethylphosphonic acid;6-chloro-9-[3-[di(propan-2-yloxy)phosphorylmethoxy]-2,2-dimethylpropyl]purin-2-amine;6-chloro-9-[2-[di(propan-2-yloxy)phosphorylmethoxymethyl]prop-2-enyl]purin-2-amine;[3-(2,6-diaminopurin-9-yl)-2,2-dimethylpropoxy]methylphosphonic acid;[1-[(2,6-diaminopurin-9-yl)methyl]cyclopropyl]methoxymethylphosphonic acid;2-[(2,6-diaminopurin-9-yl)methyl]prop-2-enoxymethylphosphonic acid;9-[[1-[di(propan-2-yloxy)phosphorylmethoxymethyl]cyclopropyl]methyl]purine-2,6-diamine
CID 162145196
3-(2-amino-6-oxo-1H-purin-9-yl)propylsulfanylmethylphosphonic acid
CID 155552605

Frequently Asked Questions

What is the IUPAC name of 2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethylphosphonic acid;[2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate;[(2S)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropyl]sulfanylmethylphosphonic acid?
The IUPAC name of 2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethylphosphonic acid;[2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate;[(2S)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropyl]sulfanylmethylphosphonic acid (CID 160660124) is 2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethylphosphonic acid;[2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate;[(2S)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropyl]sulfanylmethylphosphonic acid.
What is the SMILES notation for 2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethylphosphonic acid;[2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate;[(2S)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropyl]sulfanylmethylphosphonic acid?
The canonical SMILES for 2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethylphosphonic acid;[2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate;[(2S)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropyl]sulfanylmethylphosphonic acid is C=C(COCP(=O)(O)O)Cn1cnc2c(=O)[nH]c(N)nc21.C=C(COCP(=O)(OCOC(=O)OC(C)C)OCOC(=O)OC(C)C)Cn1cnc2c(=O)[nH]c(N)nc21.CC(COCP(=O)(O)O)Cn1cnc2c(=O)[nH]c(N)nc21.C[C@@H](COCP(=O)(O)O)Cn1cnc2c(=O)[nH]c(N)nc21.C[C@@H](CSCP(=O)(O)O)Cn1cnc2c(=O)[nH]c(N)nc21.C[C@H](COCP(=O)(O)O)Cn1cnc2c(=O)[nH]c(N)nc21.
What is the InChIKey of 2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethylphosphonic acid;[2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate;[(2S)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropyl]sulfanylmethylphosphonic acid?
The InChIKey is RLOFQLAZAPXSFX-QPFXXSLZSA-N. The full InChI is InChI=1S/C20H30N5O11P.3C10H16N5O5P.C10H14N5O5P.C10H16N5O4PS/c1-12(2)35-19(27)31-9-33-37(29,34-10-32-20(28)36-13(3)4)11-30-7-14(5)6-25-8-22-15-16(25)23-18(21)24-17(15)26;4*1-6(3-20-5-21(17,18)19)2-15-4-12-7-8(15)13-10(11)14-9(7)16;1-6(3-21-5-20(17,18)19)2-15-4-12-7-8(15)13-10(11)14-9(7)16/h8,12-13H,5-7,9-11H2,1-4H3,(H3,21,23,24,26);3*4,6H,2-3,5H2,1H3,(H2,17,18,19)(H3,11,13,14,16);4H,1-3,5H2,(H2,17,18,19)(H3,11,13,14,16);4,6H,2-3,5H2,1H3,(H2,17,18,19)(H3,11,13,14,16)/t;2*6-;;;6-/m.10..1/s1.
What are the key properties of 2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethylphosphonic acid;[2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate;[(2S)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropyl]sulfanylmethylphosphonic acid?
2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethylphosphonic acid;[2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate;[(2S)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropyl]sulfanylmethylphosphonic acid has a molecular weight of 2147.72 g/mol, XLogP of 0.58, 44 rotatable bonds, 22 hydrogen bond donors, and 50 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethylphosphonic acid;[2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]prop-2-enoxymethyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate;[(2S)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropoxy]methylphosphonic acid;[(2R)-3-(2-amino-6-oxo-1H-purin-9-yl)-2-methylpropyl]sulfanylmethylphosphonic acid is sourced from PubChem (CID 160660124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).