UCSF

ZINC03830926

Substance Information

In ZINC since Heavy atoms Benign functionality
September 30th, 2005 20 No

CAS Numbers: 64221-86-9 , 74431-23-5

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) -0.73 -6.68 -79.62 4 7 0 118 299.352 7

Activity (Go SEA)

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