In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 20 | Yes |
Popular Name: 1-tert-butyl-N-[(1R)-2-methyl-1-(2-thienyl)propyl]piperidin-4-amine 1-tert-butyl-N-[(1R)-2-methyl-1-…
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) | 4.31 | 8.64 | -31.86 | 2 | 2 | 1 | 16 | 295.516 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.31 | 9.66 | -102.59 | 3 | 2 | 2 | 21 | 296.524 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.31 | 7.53 | -33.92 | 2 | 2 | 1 | 20 | 295.516 | 5 | ↓ |