In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 20 | Yes |
Popular Name: 1-butyl-N-[(4-methylsulfanylphenyl)methyl]piperidin-4-amine 1-butyl-N-[(4-methylsulfanylphen…
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) | 3.79 | 9.51 | -36.56 | 2 | 2 | 1 | 16 | 293.5 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.79 | 8.47 | -42.57 | 2 | 2 | 1 | 20 | 293.5 | 7 | ↓ |