(2S)-2-amino-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;methyl (2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoate;(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid

C111H138N10O26 — CID 157467676

IUPAC(2S)-2-amino-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;methyl (2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoate;(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid
SMILESCC(C)(C)OC(=O)Cn1cc(C[C@H](N)C(=O)O)c2ccccc21.CC(C)(C)OC(=O)Cn1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)c2ccccc21.CC(C)(C)OC(=O)Cn1cc(C[C@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C(=O)O)c2ccccc21.COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C.COC(=O)[C@H](Cc1cn(CC(=O)OC(C)(C)C)c2ccccc12)NC(=O)OC(C)(C)C
InChIInChI=1S/C32H32N2O6.C23H32N2O6.C22H30N2O6.2C17H22N2O4/c1-32(2,3)40-29(35)18-34-17-20(21-10-8-9-15-28(21)34)16-27(30(36)37)33-31(38)39-19-26-24-13-6-4-11-22(24)23-12-5-7-14-25(23)26;1-22(2,3)30-19(26)14-25-13-15(16-10-8-9-11-18(16)25)12-17(20(27)29-7)24-21(28)31-23(4,5)6;1-21(2,3)29-18(25)13-24-12-14(15-9-7-8-10-17(15)24)11-16(19(26)27)23-20(28)30-22(4,5)6;1-17(2,3)23-16(21)19-14(15(20)22-4)9-11-10-18-13-8-6-5-7-12(11)13;1-17(2,3)23-15(20)10-19-9-11(8-13(18)16(21)22)12-6-4-5-7-14(12)19/h4-15,17,26-27H,16,18-19H2,1-3H3,(H,33,38)(H,36,37);8-11,13,17H,12,14H2,1-7H3,(H,24,28);7-10,12,16H,11,13H2,1-6H3,(H,23,28)(H,26,27);5-8,10,14,18H,9H2,1-4H3,(H,19,21);4-7,9,13H,8,10,18H2,1-3H3,(H,21,22)/t27-;17-;16-;14-;13-/m00000/s1
InChIKeyBUQZTSTWSFFSRN-CUVAMAQESA-N
MW2028.37 g/mol
LogP17.33
Rot. Bonds29

About (2S)-2-amino-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;methyl (2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoate;(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid

(2S)-2-amino-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;methyl (2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoate;(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid (PubChem CID 157467676) has the molecular formula C111H138N10O26 and a molecular weight of 2028.37 g/mol. Its IUPAC name is (2S)-2-amino-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;methyl (2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoate;(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid.

Molecular Properties

Compound Name(2S)-2-amino-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;methyl (2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoate;(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid
PubChem CID157467676
Molecular FormulaC111H138N10O26
Molecular Weight2028.37 g/mol
Exact Mass2026.98
IUPAC Name(2S)-2-amino-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;methyl (2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoate;(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid
SMILESCC(C)(C)OC(=O)Cn1cc(C[C@H](N)C(=O)O)c2ccccc21.CC(C)(C)OC(=O)Cn1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)c2ccccc21.CC(C)(C)OC(=O)Cn1cc(C[C@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C(=O)O)c2ccccc21.COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C.COC(=O)[C@H](Cc1cn(CC(=O)OC(C)(C)C)c2ccccc12)NC(=O)OC(C)(C)C
InChIInChI=1S/C32H32N2O6.C23H32N2O6.C22H30N2O6.2C17H22N2O4/c1-32(2,3)40-29(35)18-34-17-20(21-10-8-9-15-28(21)34)16-27(30(36)37)33-31(38)39-19-26-24-13-6-4-11-22(24)23-12-5-7-14-25(23)26;1-22(2,3)30-19(26)14-25-13-15(16-10-8-9-11-18(16)25)12-17(20(27)29-7)24-21(28)31-23(4,5)6;1-21(2,3)29-18(25)13-24-12-14(15-9-7-8-10-17(15)24)11-16(19(26)27)23-20(28)30-22(4,5)6;1-17(2,3)23-16(21)19-14(15(20)22-4)9-11-10-18-13-8-6-5-7-12(11)13;1-17(2,3)23-15(20)10-19-9-11(8-13(18)16(21)22)12-6-4-5-7-14(12)19/h4-15,17,26-27H,16,18-19H2,1-3H3,(H,33,38)(H,36,37);8-11,13,17H,12,14H2,1-7H3,(H,24,28);7-10,12,16H,11,13H2,1-6H3,(H,23,28)(H,26,27);5-8,10,14,18H,9H2,1-4H3,(H,19,21);4-7,9,13H,8,10,18H2,1-3H3,(H,21,22)/t27-;17-;16-;14-;13-/m00000/s1
InChIKeyBUQZTSTWSFFSRN-CUVAMAQESA-N
XLogP17.33
TPSA484.55 Ų
H-Bond Donors9
H-Bond Acceptors28
Rotatable Bonds29
Heavy Atoms147
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002028.37
LogP ≤ 517.33
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1028

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}

Analyze (2S)-2-amino-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;methyl (2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoate;(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid with MolForge

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Related Compounds

N-[(9H-fluoren-9-ylmethoxy)carbonyl]-L-tryptophan
CID 100107
Fmoc-Trp-D-Phe-ol
CID 42632248
[(2R)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(1H-indol-3-yl)propanoyl]amino]-3-phenylpropyl] acetate
CID 42630938
(2R)-2-[[4-[3-[3-[3-[[1,7-bis[[(1R)-1-carboxy-2-(1H-indol-3-yl)ethyl]amino]-4-[3-[[(1R)-1-carboxy-2-(1H-indol-3-yl)ethyl]amino]-3-oxopropyl]-1,7-dioxoheptan-4-yl]amino]-3-oxopropoxy]-2,2-bis[[3-[[1,7-bis[[(1R)-1-carboxy-2-(1H-indol-3-yl)ethyl]amino]-4-[3-[[(1R)-1-carboxy-2-(1H-indol-3-yl)ethyl]amino]-3-oxopropyl]-1,7-dioxoheptan-4-yl]amino]-3-oxopropoxy]methyl]propoxy]propanoylamino]-7-[[(1R)-1-carboxy-2-(1H-indol-3-yl)ethyl]amino]-4-[3-[[(1R)-1-carboxy-2-(1H-indol-3-yl)ethyl]amino]-3-oxopropyl]-7-oxoheptanoyl]amino]-3-(1H-indol-3-yl)propanoic acid
CID 155533241
Fmoc-Trp-Phe-ol
CID 42632247
Fmoc-L-tryptophan
CID 978343
(2S)-3-{1-[(tert-butoxy)carbonyl]-1H-indol-3-yl}-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)propanoic acid
CID 9849766
[(2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(1H-indol-3-yl)propanoyl]amino]-3-phenylpropyl] acetate
CID 42630937
Pwgf(CH2NH)wwfw
CID 44302261
(2S)-2-[[4-[3-[3-[3-[[1,7-bis[[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]amino]-4-[3-[[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]amino]-3-oxopropyl]-1,7-dioxoheptan-4-yl]amino]-3-oxopropoxy]-2,2-bis[[3-[[1,7-bis[[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]amino]-4-[3-[[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]amino]-3-oxopropyl]-1,7-dioxoheptan-4-yl]amino]-3-oxopropoxy]methyl]propoxy]propanoylamino]-7-[[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]amino]-4-[3-[[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]amino]-3-oxopropyl]-7-oxoheptanoyl]amino]-3-(1H-indol-2-yl)propanoic acid
CID 168279390
Fmoc-Lys-Trp-Lys-Lys-Lys(1)-Lys(2)-Gly-OH.Fmoc-Lys-Trp-Lys-Lys-Lys(3)-(2).Fmoc-Lys-Trp-Lys-Lys-(3).Fmoc-Lys-Trp-Lys-Lys-(1)
CID 168291335
Fmoc-Lys-Lys-Trp-Lys-Lys(1)-Lys(2)-Gly-OH.Fmoc-Lys-Lys-Trp-Lys-Lys(3)-(2).Fmoc-Lys-Lys-Trp-Lys-(3).Fmoc-Lys-Lys-Trp-Lys-(1)
CID 168291921

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;methyl (2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoate;(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid?
The IUPAC name of (2S)-2-amino-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;methyl (2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoate;(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid (CID 157467676) is (2S)-2-amino-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;methyl (2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoate;(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid.
What is the SMILES notation for (2S)-2-amino-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;methyl (2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoate;(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid?
The canonical SMILES for (2S)-2-amino-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;methyl (2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoate;(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid is CC(C)(C)OC(=O)Cn1cc(C[C@H](N)C(=O)O)c2ccccc21.CC(C)(C)OC(=O)Cn1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)c2ccccc21.CC(C)(C)OC(=O)Cn1cc(C[C@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C(=O)O)c2ccccc21.COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C.COC(=O)[C@H](Cc1cn(CC(=O)OC(C)(C)C)c2ccccc12)NC(=O)OC(C)(C)C.
What is the InChIKey of (2S)-2-amino-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;methyl (2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoate;(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid?
The InChIKey is BUQZTSTWSFFSRN-CUVAMAQESA-N. The full InChI is InChI=1S/C32H32N2O6.C23H32N2O6.C22H30N2O6.2C17H22N2O4/c1-32(2,3)40-29(35)18-34-17-20(21-10-8-9-15-28(21)34)16-27(30(36)37)33-31(38)39-19-26-24-13-6-4-11-22(24)23-12-5-7-14-25(23)26;1-22(2,3)30-19(26)14-25-13-15(16-10-8-9-11-18(16)25)12-17(20(27)29-7)24-21(28)31-23(4,5)6;1-21(2,3)29-18(25)13-24-12-14(15-9-7-8-10-17(15)24)11-16(19(26)27)23-20(28)30-22(4,5)6;1-17(2,3)23-16(21)19-14(15(20)22-4)9-11-10-18-13-8-6-5-7-12(11)13;1-17(2,3)23-15(20)10-19-9-11(8-13(18)16(21)22)12-6-4-5-7-14(12)19/h4-15,17,26-27H,16,18-19H2,1-3H3,(H,33,38)(H,36,37);8-11,13,17H,12,14H2,1-7H3,(H,24,28);7-10,12,16H,11,13H2,1-6H3,(H,23,28)(H,26,27);5-8,10,14,18H,9H2,1-4H3,(H,19,21);4-7,9,13H,8,10,18H2,1-3H3,(H,21,22)/t27-;17-;16-;14-;13-/m00000/s1.
What are the key properties of (2S)-2-amino-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;methyl (2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoate;(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid?
(2S)-2-amino-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;methyl (2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoate;(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid has a molecular weight of 2028.37 g/mol, XLogP of 17.33, 29 rotatable bonds, 9 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid;methyl (2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoate;(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]indol-3-yl]propanoic acid is sourced from PubChem (CID 157467676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).