UCSF

ZINC32270124

Substance Information

In ZINC since Heavy atoms Benign functionality
April 26th, 2009 26 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) 2.66 3.44 -17.11 1 6 0 68 377.51 7
Mid Mid (pH 6-8) 2.66 5.43 -52.71 2 6 1 69 378.518 7

Activity (Go SEA)

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