In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: 1-(1-methylpyrrol-3-yl)-2-[methyl-[[(2R)-tetrahydropyran-2-yl]methyl]amino]ethanone 1-(1-methylpyrrol-3-yl)-2-[methy…
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) | 1.28 | 8.1 | -35.39 | 1 | 4 | 1 | 36 | 251.35 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.28 | 5.79 | -9.8 | 0 | 4 | 0 | 34 | 250.342 | 5 | ↓ |