UCSF

ZINC01844865

Substance Information

In ZINC since Heavy atoms Benign functionality
October 9th, 2004 21 Yes

CAS Number: 66635-85-6

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) 2.26 0.87 -47.57 0 5 -1 71 284.291 4

Activity (Go SEA)

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