In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2008 | 15 | Yes |
Popular Name: 1-[(4-methylpiperazin-1-yl)methyl]cyclohexan-1-amine 1-[(4-methylpiperazin-1-yl)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) | 1.62 | 4.43 | -94.69 | 4 | 3 | 2 | 35 | 213.369 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.62 | 3.78 | -120.79 | 4 | 3 | 2 | 35 | 213.369 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.62 | 1.97 | -38.63 | 3 | 3 | 1 | 34 | 212.361 | 2 | ↓ |