In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2010 | 20 | Yes |
Popular Name: (2R)-N1-[(1S)-1-cyclopropylethyl]-N1-(2-methoxyethyl)-2-phenyl-propane-1,2-diamine (2R)-N1-[(1S)-1-cyclopropylethyl…
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) | 2.97 | 5.57 | -35.39 | 3 | 3 | 1 | 40 | 277.432 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.97 | 5.28 | -1.69 | 2 | 3 | 0 | 38 | 276.424 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.97 | 7.32 | -32.01 | 3 | 3 | 1 | 40 | 277.432 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.97 | 7.54 | -112.46 | 4 | 3 | 2 | 41 | 278.44 | 8 | ↓ |