UCSF

ZINC42804702

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 4th, 2010 46 No

Popular Name: (3R)-N-[(1S)-2-[[(1S)-2-amino-1-benzyl-2-oxo-ethyl]amino]-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]-1-[(2 (3R)-N-[(1S)-2-[[(1S)-2-amino-1-…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 1.86 5.07 -61.08 9 11 1 185 625.75 12 ↓
Mid Mid (pH 6-8) 1.86 4.75 -25.18 8 11 0 184 624.742 12 ↓

Activity (Go SEA)

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