In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 18 | Yes |
Popular Name: [2-(4-cyclopropylpiperazin-1-yl)-6-methyl-3-pyridyl]methanamine [2-(4-cyclopropylpiperazin-1-yl)…
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) | 0.59 | 6.73 | -184.51 | 5 | 4 | 3 | 49 | 249.382 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.59 | 6.28 | -102.41 | 4 | 4 | 2 | 48 | 248.374 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.59 | 4.08 | -47.34 | 3 | 4 | 1 | 47 | 247.366 | 3 | ↓ |