In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 19 | Yes |
Popular Name: (1S,2S)-N1-cyclohexyl-N1-methyl-1-(p-tolyl)propane-1,2-diamine (1S,2S)-N1-cyclohexyl-N1-methyl-…
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) | 3.48 | 8.38 | -124.7 | 4 | 2 | 2 | 32 | 262.441 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.48 | 8.08 | -33.21 | 3 | 2 | 1 | 30 | 261.433 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.48 | 6.68 | -43.9 | 3 | 2 | 1 | 31 | 261.433 | 4 | ↓ |