UCSF

ZINC70706354

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2011 38 Yes

Popular Name: (2R)-2-[[(2S,3S)-2-[[(2R)-2-(2,4-dioxo-1H-quinazolin-3-yl)-3-phenyl-propanoyl]amino]-3-methyl-pentan (2R)-2-[[(2S,3S)-2-[[(2R)-2-(2,4…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 1.21 11.75 -63.81 3 10 -1 153 521.594 11 ↓
Hi High (pH 8-9.5) 1.67 10.1 -114.52 2 10 -2 156 520.586 11 ↓

Activity (Go SEA)

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