| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 21 | Yes |
Popular Name: (1S,2S)-N1-cyclopropyl-1-(3-methyl-2-thienyl)-N1-(3-thienylmethyl)butane-1,2-diamine (1S,2S)-N1-cyclopropyl-1-(3-meth…
| 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) | 3.29 | 8.45 | -28.38 | 3 | 2 | 1 | 30 | 321.535 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.29 | 6.57 | -45.04 | 3 | 2 | 1 | 31 | 321.535 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.29 | 8.76 | -107.88 | 4 | 2 | 2 | 32 | 322.543 | 7 | ↓ |
