In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2008 | 26 | Yes |
Popular Name: 6-(4-ethylpiperazin-1-yl)-N-[2-[(2S)-1-methyl-2-piperidyl]ethyl]pyridine-3-carboxamide 6-(4-ethylpiperazin-1-yl)-N-[2-[…
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) | 1.80 | 8.62 | -84.01 | 3 | 6 | 2 | 54 | 361.534 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.80 | 6.32 | -40.61 | 2 | 6 | 1 | 53 | 360.526 | 6 | ↓ |