UCSF

ZINC02572409

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 31 Yes

CAS Number: 269078-74-2

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) 6.67 13.05 -59.05 1 5 -1 78 414.481 9

Activity (Go SEA)

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