UCSF

ZINC43620097

Substance Information

In ZINC since Heavy atoms Benign functionality
May 16th, 2010 27 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) 0.37 7.63 -21.69 0 7 0 71 367.453 4
Lo Low (pH 4.5-6) 0.37 8.1 -58.44 1 7 1 73 368.461 4

Activity (Go SEA)

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