UCSF

ZINC09422339

Substance Information

In ZINC since Heavy atoms Benign functionality
August 25th, 2007 22 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) 0.19 -2.78 -51.69 3 7 1 84 302.358 4
Lo Low (pH 4.5-6) 0.19 -2.67 -110.99 4 7 2 85 303.366 4

Activity (Go SEA)

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