In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 11th, 2006 | 26 | Yes |
Popular Name: N-(3-pyridylmethyl)-2-(1,2,3,4-tetrahydroacridin-9-ylsulfanyl)acetamide N-(3-pyridylmethyl)-2-(1,2,3,4-t…
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) | 3.27 | 8.78 | -12.29 | 1 | 4 | 0 | 55 | 363.486 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.27 | 9.02 | -34.04 | 2 | 4 | 1 | 56 | 364.494 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.27 | 9.06 | -45.43 | 2 | 4 | 1 | 56 | 364.494 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.27 | 9.3 | -77.53 | 3 | 4 | 2 | 57 | 365.502 | 5 | ↓ |