In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 21 | Yes |
Popular Name: (1R,2R)-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2-phenyl-cyclohexanamine (1R,2R)-N-[[(2S)-1-ethylpyrrolid…
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) | 4.36 | 9.92 | -31.31 | 2 | 2 | 1 | 20 | 287.471 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.36 | 10.86 | -29.4 | 2 | 2 | 1 | 16 | 287.471 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.36 | 11.79 | -107.63 | 3 | 2 | 2 | 21 | 288.479 | 5 | ↓ |