UCSF

ZINC02379561

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2004 13 Yes

CAS Numbers: 146255-66-5 , 162870-29-3

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) -2.36 -2.44 -39.33 5 5 0 108 183.163 2

Activity (Go SEA)

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