UCSF

ZINC06732067

Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2006 13 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) -0.78 0.94 -96.4 5 5 1 94 182.203 4

Activity (Go SEA)

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