In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 20 | Yes |
Popular Name: 1-butyl-N-[(3,4-dimethylphenyl)methyl]piperidin-4-amine 1-butyl-N-[(3,4-dimethylphenyl)m…
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) | 4.18 | 9.69 | -34.81 | 2 | 2 | 1 | 16 | 275.46 | 6 | ↓ |
Lo Low (pH 4.5-6) | 4.18 | 10.88 | -108.22 | 3 | 2 | 2 | 21 | 276.468 | 6 | ↓ |