UCSF

ZINC01776880

Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2004 25 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) 0.27 13.02 -33.33 2 5 1 61 338.431 7
Ref Reference (pH 7) 0.27 13.03 -33.28 2 5 1 61 338.431 7

Activity (Go SEA)

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