UCSF

ZINC35391255

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2009 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) -1.17 4.31 -39.79 3 7 0 106 287.36 9
Hi High (pH 8-9.5) -1.17 3.18 -63.61 2 7 -1 102 286.352 9

Activity (Go SEA)

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