UCSF

ZINC00402833

Substance Information

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

CAS Numbers: 125410-18-6 , 1803-60-7

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) 0.36 0.58 -7.09 2 4 0 58 184.239 2

Activity (Go SEA)

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