UCSF

ZINC13208086

Substance Information

In ZINC since Heavy atoms Benign functionality
June 11th, 2008 17 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) -0.07 6.94 -10.21 0 5 0 66 237.255 7
Lo Low (pH 4.5-6) -0.07 7.21 -41.22 1 5 1 67 238.263 7

Activity (Go SEA)

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