In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 18 | Yes |
Popular Name: (1R,2S)-N2-methyl-N2-[(1R,3S)-3-methylcyclohexyl]-N1-propyl-cyclopentane-1,2-diamine (1R,2S)-N2-methyl-N2-[(1R,3S)-3-…
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) | 3.80 | 10.03 | -1.81 | 3 | 2 | 0 | 21 | 254.462 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.80 | 10.11 | 0.35 | 2 | 2 | 0 | 16 | 253.454 | 5 | ↓ |