UCSF

ZINC32577610

Substance Information

In ZINC since Heavy atoms Benign functionality
May 4th, 2009 14 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 2.33 3.75 -37.96 3 2 1 29 197.346 2
Mid Mid (pH 6-8) 2.33 4.01 -39.13 3 2 1 29 197.346 2

Activity (Go SEA)

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