| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 20 | Yes |
Popular Name: (1S)-N,N-dibutyl-1-(3,4-dimethylphenyl)ethane-1,2-diamine (1S)-N,N-dibutyl-1-(3,4-dimethyl…
| 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) | 4.43 | 9.53 | -127.76 | 4 | 2 | 2 | 32 | 278.484 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.43 | 10.03 | -29.12 | 3 | 2 | 1 | 30 | 277.476 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.43 | 8.25 | -46.57 | 3 | 2 | 1 | 31 | 277.476 | 9 | ↓ |
