| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 18 | Yes |
Popular Name: (3S,4R)-N3-[(1S)-1-cyclopropylethyl]-N3-methyl-N4-propyl-heptane-3,4-diamine (3S,4R)-N3-[(1S)-1-cyclopropylet…
| 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) | 4.50 | 9.65 | -104.47 | 3 | 2 | 2 | 21 | 256.478 | 10 | ↓ |
| Hi High (pH 8-9.5) | 4.50 | 8.68 | -28.58 | 2 | 2 | 1 | 16 | 255.47 | 10 | ↓ |
| Hi High (pH 8-9.5) | 4.50 | 7.86 | -35.63 | 2 | 2 | 1 | 20 | 255.47 | 10 | ↓ |
