In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2011 | 19 | Yes |
Popular Name: N-[(2S)-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-2-morpholino-ethyl]acetamide N-[(2S)-2-(1-methyl-3,6-dihydro-…
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) | -0.06 | 2.47 | -41 | 2 | 5 | 1 | 46 | 268.381 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.06 | 0.04 | -7.83 | 1 | 5 | 0 | 45 | 267.373 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.06 | 4.73 | -104.64 | 3 | 5 | 2 | 47 | 269.389 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.