In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 20 | Yes |
Popular Name: (1R)-N'-[(1R,2S)-2-methoxycyclohexyl]-N,N-dimethyl-1-phenyl-ethane-1,2-diamine (1R)-N'-[(1R,2S)-2-methoxycycloh…
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) | 3.08 | 8.97 | -31.7 | 2 | 3 | 1 | 26 | 277.432 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.08 | 6.6 | -2.3 | 1 | 3 | 0 | 24 | 276.424 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.08 | 8.74 | -111.71 | 3 | 3 | 2 | 30 | 278.44 | 6 | ↓ |