In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 26 | Yes |
Popular Name: [4-(2-pyridylmethyl)-1-piperidyl]-(4-pyrrol-1-ylphenyl)methanone [4-(2-pyridylmethyl)-1-piperidyl…
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) | 2.57 | 11.7 | -10.34 | 0 | 4 | 0 | 38 | 345.446 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.57 | 12.17 | -42.17 | 1 | 4 | 1 | 39 | 346.454 | 4 | ↓ |