In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2011 | 18 | Yes |
Popular Name: 6-[[(2S)-4-ethylmorpholin-2-yl]methylamino]pyridine-3-carbonitrile 6-[[(2S)-4-ethylmorpholin-2-yl]m…
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) | 0.89 | 2.9 | -7.35 | 1 | 5 | 0 | 61 | 246.314 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.89 | 5.19 | -45.52 | 2 | 5 | 1 | 62 | 247.322 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.