UCSF

ZINC03201891

Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2004 23 No

Download: MOL2 SDF SMILES Flexibase

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) -1.52 -3.24 -145.96 4 12 -2 192 345.208 4
Mid Mid (pH 6-8) -1.52 -4.39 -53.95 5 12 -1 189 346.216 4

Activity (Go SEA)

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