| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2009 | 19 | Yes |
Popular Name: (1S,2R)-N2-methyl-1-phenyl-N2-(3-pyridylmethyl)propane-1,2-diamine (1S,2R)-N2-methyl-1-phenyl-N2-(3…
| 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) | -0.05 | 4.54 | -49.47 | 3 | 3 | 1 | 44 | 256.373 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.05 | 4.22 | -5.48 | 2 | 3 | 0 | 42 | 255.365 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -0.05 | 6.62 | -123.53 | 4 | 3 | 2 | 45 | 257.381 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -0.05 | 5.01 | -89.14 | 4 | 3 | 2 | 45 | 257.381 | 5 | ↓ |
