UCSF

ZINC38473030

Substance Information

In ZINC since Heavy atoms Benign functionality
January 25th, 2010 35 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) 0.74 11.12 -67.79 1 9 -1 117 483.541 11
Mid Mid (pH 6-8) 0.74 11.97 -60.29 2 9 0 122 484.549 11

Activity (Go SEA)

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