In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2008 | 16 | Yes |
Popular Name: (1-aminocyclohexyl)-(4-methylpiperazin-1-yl)methanone (1-aminocyclohexyl)-(4-methylpip…
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) | 0.94 | 1.86 | -47.91 | 3 | 4 | 1 | 51 | 226.344 | 1 | ↓ |
Hi High (pH 8-9.5) | 0.94 | 1.59 | -8.81 | 2 | 4 | 0 | 50 | 225.336 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.94 | 4.24 | -114.6 | 4 | 4 | 2 | 52 | 227.352 | 1 | ↓ |