UCSF

ZINC05439454

Substance Information

In ZINC since Heavy atoms Benign functionality
February 2nd, 2006 23 No

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) 3.65 -2.49 -42.6 4 2 1 47 318.525 1

Activity (Go SEA)

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