UCSF

ZINC32128817

Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2009 20 No

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) -1.01 5.03 -70.98 1 7 0 85 283.328 3
Hi High (pH 8-9.5) -1.01 2.83 -59.94 0 7 -1 84 282.32 3

Activity (Go SEA)

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