UCSF

ZINC34865213

Substance Information

In ZINC since Heavy atoms Benign functionality
September 29th, 2009 31 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) -4.43 10.39 -190.13 1 11 -3 171 434.425 11
Hi High (pH 8-9.5) -4.43 7.96 -275.31 0 11 -4 170 433.417 11

Activity (Go SEA)

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