In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 16 | Yes |
Popular Name: (1R,2S)-N2-cyclopropyl-N2-(2-methoxyethyl)-N1-methyl-cyclohexane-1,2-diamine (1R,2S)-N2-cyclopropyl-N2-(2-met…
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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) | 1.87 | 6.53 | -100.17 | 3 | 3 | 2 | 30 | 228.38 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.86 | 4.67 | -30.68 | 2 | 3 | 1 | 29 | 227.372 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.86 | 3.87 | -0.8 | 1 | 3 | 0 | 24 | 226.364 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.87 | 5.63 | -28.45 | 2 | 3 | 1 | 26 | 227.372 | 6 | ↓ |