In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 19 | Yes |
Popular Name: (1-aminocyclohexyl)-(4-isobutylpiperazin-1-yl)methanone (1-aminocyclohexyl)-(4-isobutylp…
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) | 2.06 | 3.9 | -47.14 | 3 | 4 | 1 | 51 | 268.425 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.06 | 4.32 | -5.96 | 2 | 4 | 0 | 50 | 267.417 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.06 | 5.75 | -114.46 | 4 | 4 | 2 | 52 | 269.433 | 3 | ↓ |