In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2011 | 24 | Yes |
Popular Name: 1-[3-(2-methoxyphenoxy)propyl]-4-(1-methylpyrazol-4-yl)-3,6-dihydro-2H-pyridine 1-[3-(2-methoxyphenoxy)propyl]-4…
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) | 2.27 | 9.97 | -46.86 | 1 | 5 | 1 | 41 | 328.436 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.27 | 7.7 | -11.14 | 0 | 5 | 0 | 40 | 327.428 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.