UCSF

ZINC29562604

Substance Information

In ZINC since Heavy atoms Benign functionality
March 15th, 2009 18 Yes

CAS Numbers: 175481-36-4 , 175481-37-5

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) -0.06 2.84 -16.46 2 5 0 67 250.298 6

Activity (Go SEA)

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