In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 17 | Yes |
Popular Name: (2R)-N2-(1-ethylpropyl)-N2-methyl-3-phenyl-propane-1,2-diamine (2R)-N2-(1-ethylpropyl)-N2-methy…
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) | 2.68 | 5.67 | -43.49 | 3 | 2 | 1 | 31 | 235.395 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.68 | 5.48 | -1.62 | 2 | 2 | 0 | 29 | 234.387 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.68 | 7.53 | -29.78 | 3 | 2 | 1 | 30 | 235.395 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.68 | 7.82 | -115.38 | 4 | 2 | 2 | 32 | 236.403 | 7 | ↓ |