In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 15th, 2011 | 25 | Yes |
Popular Name: N-(1,3-benzothiazol-2-yl)-N-(2-methoxyethyl)-1-prop-2-ynyl-piperidine-4-carboxamide N-(1,3-benzothiazol-2-yl)-N-(2-m…
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) | 2.87 | 8.77 | -10.2 | 0 | 5 | 0 | 46 | 357.479 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.87 | 11.06 | -40.1 | 1 | 5 | 1 | 47 | 358.487 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.