UCSF

ZINC59700941

Substance Information

In ZINC since Heavy atoms Benign functionality
March 9th, 2011 19 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) -3.01 -8.12 -15.14 6 8 0 139 279.289 4

Activity (Go SEA)

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