UCSF

ZINC16917443

Substance Information

In ZINC since Heavy atoms Benign functionality
September 10th, 2008 28 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) -0.13 9.81 -64.38 0 12 -1 172 405.332 15

Activity (Go SEA)

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