UCSF

ZINC00900569

Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2005 25 Yes

CAS Number: 66304-03-8

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) 2.21 -2.28 -38.69 3 4 1 53 339.459 6

Activity (Go SEA)

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