UCSF

ZINC34682472

Substance Information

In ZINC since Heavy atoms Benign functionality
September 22nd, 2009 27 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) 4.12 12.25 -63.52 1 3 1 25 377.43 5
Mid Mid (pH 6-8) 4.12 9.95 -10.56 0 3 0 24 376.422 5

Activity (Go SEA)

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