UCSF

ZINC24515308

Substance Information

In ZINC since Heavy atoms Benign functionality
January 17th, 2009 20 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) 1.53 5.69 -35.27 3 4 1 55 275.372 6
Mid Mid (pH 6-8) 1.53 4.59 -9.49 2 4 0 50 274.364 6

Activity (Go SEA)

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