UCSF

ZINC43677334

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 17th, 2010 43 No

Popular Name: (2R)-2-[[2-[[(2R)-2-[[(2R)-2-amino-3-phenyl-propanoyl]amino]-3-phenyl-propanoyl]amino]acetyl]amino]- (2R)-2-[[2-[[(2R)-2-[[(2R)-2-ami…

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Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.41 4.18 -52.64 9 11 1 187 613.805 18 ↓
Mid Mid (pH 6-8) 1.41 4.36 -16.71 8 11 0 186 612.797 18 ↓

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )