UCSF

ZINC62447924

Substance Information

In ZINC since Heavy atoms Benign functionality
May 1st, 2011 25 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) 3.26 8.35 -11.84 0 4 0 33 338.451 4
Lo Low (pH 4.5-6) 3.26 10.37 -39.05 1 4 1 34 339.459 4

Activity (Go SEA)

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