UCSF

ZINC26511557

Substance Information

In ZINC since Heavy atoms Benign functionality
February 7th, 2009 16 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) 1.96 3.17 -11.44 3 4 0 64 221.235 3
Lo Low (pH 4.5-6) 1.96 3.27 -32.06 4 4 1 65 222.243 3

Activity (Go SEA)

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