In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 17 | Yes |
Popular Name: 4-[3-[cyclohexyl(methyl)amino]propylamino]butan-1-ol 4-[3-[cyclohexyl(methyl)amino]pr…
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) | 1.86 | 5.56 | -106.04 | 4 | 3 | 2 | 41 | 244.423 | 9 | ↓ |
Hi High (pH 8-9.5) | 1.86 | 3.27 | -40.61 | 3 | 3 | 1 | 40 | 243.415 | 9 | ↓ |
Hi High (pH 8-9.5) | 1.86 | 4.22 | -34.95 | 3 | 3 | 1 | 37 | 243.415 | 9 | ↓ |