UCSF

ZINC32024719

Substance Information

In ZINC since Heavy atoms Benign functionality
April 19th, 2009 16 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) -0.07 4.19 -52.38 2 5 0 74 230.308 8
Hi High (pH 8-9.5) -0.07 1.99 -44 1 5 -1 72 229.3 8

Activity (Go SEA)

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