In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 18th, 2008 | 27 | Yes |
Popular Name: 6-(4-isopropylpiperazin-1-yl)-N-[2-[(2R)-1-methyl-2-piperidyl]ethyl]pyridine-3-carboxamide 6-(4-isopropylpiperazin-1-yl)-N-…
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) | 2.10 | 8.81 | -89.21 | 3 | 6 | 2 | 54 | 375.561 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.10 | 6.54 | -45.1 | 2 | 6 | 1 | 53 | 374.553 | 6 | ↓ |