UCSF

ZINC08701718

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2007 16 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) 3.94 0.3 -4.14 1 1 0 12 235.689 3

Activity (Go SEA)

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