UCSF

ZINC37809603

Substance Information

In ZINC since Heavy atoms Benign functionality
December 1st, 2009 18 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) -1.46 -2.4 -55.81 4 6 1 102 279.382 5
Hi High (pH 8-9.5) -1.46 -2.91 -14.76 3 6 0 101 278.374 5

Activity (Go SEA)

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