UCSF

ZINC00187389

Substance Information

In ZINC since Heavy atoms Benign functionality
November 2nd, 2005 16 Yes

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) 1.78 1.92 -46.69 2 5 -1 89 222.22 3

Activity (Go SEA)

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