UCSF

ZINC62313736

Substance Information

In ZINC since Heavy atoms Benign functionality
April 29th, 2011 26 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) 3.12 8.08 -12.86 1 5 0 60 352.413 6
Lo Low (pH 4.5-6) 3.12 8.55 -41.89 2 5 1 61 353.421 6

Activity (Go SEA)

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