UCSF

ZINC14589126

Substance Information

In ZINC since Heavy atoms Benign functionality
July 12th, 2008 12 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) 2.95 6.81 -45.61 0 2 -1 40 189.3 8
Hi High (pH 8-9.5) 2.95 7.35 -95.35 0 2 -2 40 188.292 8

Activity (Go SEA)

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