UCSF

ZINC40510133

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 8th, 2010 17 No

Popular Name: 4,6-dimethyl-2-(1-piperidyl)pyridine-3-carbothioamide 4,6-dimethyl-2-(1-piperidyl)pyri…

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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) 2.62 7.14 -35.24 3 3 1 43 250.391 2 ↓
Mid Mid (pH 6-8) 2.62 6.72 -11.14 2 3 0 42 249.383 2 ↓

Activity (Go SEA)

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