| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 15 | Yes |
Popular Name: (2S)-N1-[(4-chlorophenyl)methyl]-N1-methyl-butane-1,2-diamine (2S)-N1-[(4-chlorophenyl)methyl]…
| 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) | 2.16 | 4.83 | -41.88 | 3 | 2 | 1 | 31 | 227.759 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.16 | 6.7 | -128.75 | 4 | 2 | 2 | 32 | 228.767 | 5 | ↓ |
