In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 19 | Yes |
Popular Name: 5-[4-(cyclohexylmethyl)piperazin-1-yl]pentan-1-amine 5-[4-(cyclohexylmethyl)piperazin…
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) | 2.37 | 6.6 | -84.93 | 4 | 3 | 2 | 35 | 269.477 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.37 | 4.69 | -40.89 | 3 | 3 | 1 | 34 | 268.469 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.37 | 6.94 | -91.25 | 4 | 3 | 2 | 35 | 269.477 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.37 | 8.88 | -184.06 | 5 | 3 | 3 | 37 | 270.485 | 7 | ↓ |