UCSF

ZINC16352709

Substance Information

In ZINC since Heavy atoms Benign functionality
August 26th, 2008 18 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) -0.88 4.71 -55.34 2 6 1 78 253.326 7
Hi High (pH 8-9.5) -0.88 2.51 -21.62 1 6 0 76 252.318 7

Activity (Go SEA)

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