In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 19 | Yes |
Popular Name: N-cycloheptyl-N-[[(2S)-tetrahydropyran-2-yl]methyl]propane-1,3-diamine N-cycloheptyl-N-[[(2S)-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) | 2.71 | 6.72 | -104.16 | 4 | 3 | 2 | 41 | 270.461 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.71 | 6.57 | -31.42 | 3 | 3 | 1 | 40 | 269.453 | 6 | ↓ |