UCSF

ZINC20433132

Substance Information

In ZINC since Heavy atoms Benign functionality
November 21st, 2008 19 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) 0.14 3.98 -19.51 2 4 0 50 277.393 4
Mid Mid (pH 6-8) 0.14 6.31 -57 3 4 1 51 278.401 4

Activity (Go SEA)

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