In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 18 | Yes |
Popular Name: (1R)-N-[(1R)-1,2-dimethylpropyl]-1-(3-methoxyphenyl)-N-methyl-ethane-1,2-diamine (1R)-N-[(1R)-1,2-dimethylpropyl]…
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) | 2.21 | 4.92 | -126.97 | 4 | 3 | 2 | 41 | 252.402 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.21 | 5.19 | -28.65 | 3 | 3 | 1 | 40 | 251.394 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.21 | 3.48 | -44.46 | 3 | 3 | 1 | 40 | 251.394 | 6 | ↓ |