UCSF

ZINC32187271

Substance Information

In ZINC since Heavy atoms Benign functionality
April 25th, 2009 22 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) 3.44 9.88 -38.61 2 3 1 30 303.401 6
Lo Low (pH 4.5-6) 3.44 10.36 -129.92 3 3 2 34 304.409 6

Activity (Go SEA)

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