UCSF

ZINC01611128

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 28 Yes

CAS Numbers: 61301-33-5 , [61301-33-5]

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) 5.05 2.03 -10.48 0 6 0 55 384.428 2

Activity (Go SEA)

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