| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2009 | 12 | Yes |
Popular Name: (2S)-N2-[(1S)-1-cyclopropylethyl]-N2-methyl-butane-1,2-diamine (2S)-N2-[(1S)-1-cyclopropylethyl…
| 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) | 1.21 | 1.89 | -40.1 | 3 | 2 | 1 | 31 | 171.308 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.21 | 4.56 | -112.5 | 4 | 2 | 2 | 32 | 172.316 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.21 | 4.67 | -26.16 | 3 | 2 | 1 | 30 | 171.308 | 5 | ↓ |
