UCSF

ZINC32088645

Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2009 23 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 6.08 -54.93 1 6 -1 82 327.445 7
Mid Mid (pH 6-8) 0.91 7.68 -65.27 2 6 0 83 328.453 7

Activity (Go SEA)

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