UCSF

ZINC36986845

Substance Information

In ZINC since Heavy atoms Benign functionality
November 18th, 2009 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) 0.86 2.23 -37.74 4 4 1 63 174.268 5
Hi High (pH 8-9.5) 0.86 0.48 -4.37 3 4 0 62 173.26 5

Activity (Go SEA)

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