UCSF

ZINC34753204

Substance Information

In ZINC since Heavy atoms Benign functionality
September 24th, 2009 28 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 4.09 8.92 -10.21 1 5 0 44 372.472 4
Mid Mid (pH 6-8) 4.09 9.88 -29.53 2 5 1 46 373.48 4

Activity (Go SEA)

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