UCSF

ZINC19435448

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2008 20 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) 0.89 2.63 -56.19 3 6 1 73 299.372 5
Mid Mid (pH 6-8) 0.89 1.33 -17.5 2 6 0 69 298.364 5

Activity (Go SEA)

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