UCSF

ZINC34669013

Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2009 25 Yes

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) 3.34 9.36 -10.12 0 4 0 27 357.885 5
Lo Low (pH 4.5-6) 3.34 11.52 -43.88 1 4 1 28 358.893 5

Activity (Go SEA)

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