UCSF

ZINC03888586

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2005 18 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) 2.37 -3.4 -51.02 1 5 -1 86 264.282 3
Hi High (pH 8-9.5) 2.37 -2.96 -118.97 0 5 -2 88 263.274 3

Activity (Go SEA)

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