UCSF

ZINC33706186

Substance Information

In ZINC since Heavy atoms Benign functionality
July 16th, 2009 28 No

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) 5.02 11.42 -14.44 1 6 0 86 374.396 6
Hi High (pH 8-9.5) 5.02 12.19 -48.93 0 6 -1 89 373.388 6

Activity (Go SEA)

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