UCSF

ZINC06778301

Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2006 27 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) 4.31 10.38 -23.27 1 6 0 73 365.433 8
Ref Reference (pH 7) 4.31 10.5 -15.48 1 6 0 73 365.433 8

Activity (Go SEA)

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