| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 20 | Yes |
Popular Name: (1S)-N-benzyl-N-cyclopropyl-1-(3-methyl-2-thienyl)ethane-1,2-diamine (1S)-N-benzyl-N-cyclopropyl-1-(3…
| 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) | 2.77 | 8.65 | -113.21 | 4 | 2 | 2 | 32 | 288.46 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.77 | 6.65 | -3.27 | 2 | 2 | 0 | 29 | 286.444 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.77 | 6.88 | -51.69 | 3 | 2 | 1 | 31 | 287.452 | 6 | ↓ |
