In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2010 | 14 | Yes |
Popular Name: (3R)-N-methyl-N-[[(2R)-tetrahydropyran-2-yl]methyl]pyrrolidin-3-amine (3R)-N-methyl-N-[[(2R)-tetrahydr…
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) | 1.13 | 2.21 | -38.01 | 2 | 3 | 1 | 29 | 199.318 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.13 | 1.29 | -1.79 | 1 | 3 | 0 | 24 | 198.31 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.13 | 3.55 | -31.52 | 2 | 3 | 1 | 26 | 199.318 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.13 | 4.99 | -106.81 | 3 | 3 | 2 | 30 | 200.326 | 3 | ↓ |