UCSF

ZINC34617975

Substance Information

In ZINC since Heavy atoms Benign functionality
September 1st, 2009 14 No

CAS Number: 312-84-5

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) -0.44 -1.41 -6.97 2 5 0 76 215.127 5

Activity (Go SEA)

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