UCSF

ZINC34685165

Substance Information

In ZINC since Heavy atoms Benign functionality
September 22nd, 2009 26 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 2.34 5.05 -8.72 1 5 0 48 372.538 7
Mid Mid (pH 6-8) 2.34 7.3 -45.66 2 5 1 50 373.546 7

Activity (Go SEA)

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