In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2010 | 24 | Yes |
Popular Name: 1-(3-chloro-4-cyano-isothiazol-5-yl)-N-(6-methyl-2-pyridyl)piperidine-4-carboxamide 1-(3-chloro-4-cyano-isothiazol-5…
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) | 2.50 | 7.77 | -15.61 | 1 | 6 | 0 | 82 | 361.858 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.