UCSF

ZINC15260170

Substance Information

In ZINC since Heavy atoms Benign functionality
July 22nd, 2008 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) 2.48 10.74 -46.3 1 5 1 43 369.485 7
Hi High (pH 8-9.5) 2.48 8.68 -12.95 0 5 0 42 368.477 7

Activity (Go SEA)

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