In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 18 | Yes |
Popular Name: (2R,4S)-2-methyl-N-propyl-1-[2-[(2S)-tetrahydrofuran-2-yl]ethyl]piperidin-4-amine (2R,4S)-2-methyl-N-propyl-1-[2-[…
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) | 2.01 | 5.03 | -37.26 | 2 | 3 | 1 | 29 | 255.426 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.00 | 6 | -31.73 | 2 | 3 | 1 | 26 | 255.426 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.01 | 7.15 | -100.87 | 3 | 3 | 2 | 30 | 256.434 | 6 | ↓ |