In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 35 | Yes |
Popular Name: [6-chloro-1-(4-pyridylmethyl)indol-3-yl]-[4-(2,6-dimethoxyphenyl)-1-piperidyl]methanone [6-chloro-1-(4-pyridylmethyl)ind…
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) | 4.10 | 13.29 | -17.57 | 0 | 6 | 0 | 57 | 490.003 | 6 | ↓ |
Lo Low (pH 4.5-6) | 4.10 | 13.75 | -54.38 | 1 | 6 | 1 | 58 | 491.011 | 6 | ↓ |