UCSF

ZINC37793716

Substance Information

In ZINC since Heavy atoms Benign functionality
December 1st, 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) 0.68 4.61 -45.41 1 9 -1 134 281.2 5
Lo Low (pH 4.5-6) 0.68 2.64 -9.94 2 9 0 131 282.208 5

Activity (Go SEA)

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