UCSF

ZINC32122683

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) 2.31 7.61 -100.78 4 3 2 41 278.44 6
Hi High (pH 8-9.5) 2.31 6.1 -41.86 3 3 1 37 277.432 6

Activity (Go SEA)

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