UCSF

ZINC32122680

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) 3.23 8.16 -35.13 2 3 1 26 277.432 8
Mid Mid (pH 6-8) 3.23 7.08 -42.02 2 3 1 29 277.432 8

Activity (Go SEA)

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