In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 18 | Yes |
Popular Name: 1-methyl-N-[(1S,3S)-3-(trifluoromethyl)cyclohexyl]piperidin-4-amine 1-methyl-N-[(1S,3S)-3-(trifluoro…
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) | 2.98 | 7.09 | -35.36 | 2 | 2 | 1 | 16 | 265.343 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.98 | 5.63 | -41.09 | 2 | 2 | 1 | 20 | 265.343 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.98 | 8.01 | -107.95 | 3 | 2 | 2 | 21 | 266.351 | 3 | ↓ |