UCSF

ZINC20392485

Substance Information

In ZINC since Heavy atoms Benign functionality
November 21st, 2008 31 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) 3.17 11.5 -23.84 1 6 0 72 411.437 3
Mid Mid (pH 6-8) 3.17 12.63 -18.82 0 6 0 71 410.429 3

Activity (Go SEA)

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