| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 14 | Yes |
Popular Name: (3S)-N1-[(1S)-1-cyclopropylethyl]-N3-ethyl-N1-methyl-butane-1,3-diamine (3S)-N1-[(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) | 2.30 | 7.39 | -100.85 | 3 | 2 | 2 | 21 | 200.37 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.30 | 6.37 | -29.43 | 2 | 2 | 1 | 16 | 199.362 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.30 | 5.01 | -33.95 | 2 | 2 | 1 | 20 | 199.362 | 7 | ↓ |
