UCSF

ZINC04084398

Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2005 25 Yes

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) 4.19 2.33 -49.04 2 4 1 48 346.491 11

Activity (Go SEA)

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