UCSF

ZINC15070385

Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2008 23 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) 3.01 10.11 -39.53 1 4 1 34 339.887 7
Lo Low (pH 4.5-6) 3.01 11.91 -112.49 2 4 2 35 340.895 7

Activity (Go SEA)

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