UCSF

ZINC34676840

Substance Information

In ZINC since Heavy atoms Benign functionality
September 21st, 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) 2.62 10.23 -12.37 1 8 0 74 382.468 3
Mid Mid (pH 6-8) 2.62 10.46 -35.52 2 8 1 75 383.476 3

Activity (Go SEA)

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