UCSF

ZINC06831161

Substance Information

In ZINC since Heavy atoms Benign functionality
April 27th, 2006 28 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) 1.75 4.64 -21.93 2 8 0 97 383.404 6
Ref Reference (pH 7) 1.75 4.64 -23.43 2 8 0 97 383.404 6

Activity (Go SEA)

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