UCSF

ZINC15936891

Substance Information

In ZINC since Heavy atoms Benign functionality
August 3rd, 2008 35 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) 1.41 7.08 -55.3 2 11 1 156 517.565 8
Hi High (pH 8-9.5) 1.41 7.38 -23.71 1 11 0 154 516.557 8

Activity (Go SEA)

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