In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 23 | Yes |
Popular Name: 6-[(2S)-4-(5-cyano-2-pyridyl)-2-methyl-piperazin-1-yl]pyridine-3-carbonitrile 6-[(2S)-4-(5-cyano-2-pyridyl)-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) | 1.68 | 8.58 | -10.3 | 0 | 6 | 0 | 80 | 304.357 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.