UCSF

ZINC32119811

Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2009 20 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) 0.91 1.19 -9.9 2 5 0 64 272.304 5
Mid Mid (pH 6-8) 0.91 1.62 -42.03 3 5 1 65 273.312 5

Activity (Go SEA)

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