| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2009 | 21 | Yes |
Popular Name: (1R)-1-(4-isopropylphenyl)-N-methyl-N-(2-pyridylmethyl)ethane-1,2-diamine (1R)-1-(4-isopropylphenyl)-N-met…
| 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) | 2.47 | 6.19 | -52.46 | 3 | 3 | 1 | 44 | 284.427 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.47 | 8.01 | -120.7 | 4 | 3 | 2 | 45 | 285.435 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.47 | 6.76 | -107.42 | 4 | 3 | 2 | 45 | 285.435 | 6 | ↓ |
