In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 27th, 2010 | 15 | Yes |
Popular Name: N'-cyclopropyl-N-methyl-N-[[(2S)-tetrahydropyran-2-yl]methyl]ethane-1,2-diamine N'-cyclopropyl-N-methyl-N-[[(2S)…
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) | 1.37 | 3.78 | -35.26 | 2 | 3 | 1 | 29 | 213.345 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.37 | 2.49 | -2.3 | 1 | 3 | 0 | 24 | 212.337 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.37 | 6.1 | -107.49 | 3 | 3 | 2 | 30 | 214.353 | 6 | ↓ |