UCSF

ZINC34626588

Substance Information

In ZINC since Heavy atoms Benign functionality
September 1st, 2009 27 No

Download: MOL2 SDF SMILES Flexibase

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) 0.72 10.34 -98.71 3 7 2 88 370.501 7
Hi High (pH 8-9.5) 0.72 8.95 -40.83 2 7 1 84 369.493 7

Activity (Go SEA)

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