| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 20 | Yes |
Popular Name: (1S)-N-benzyl-1-(5-methyl-2-thienyl)-N-propyl-ethane-1,2-diamine (1S)-N-benzyl-1-(5-methyl-2-thie…
| 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) | 3.13 | 9.26 | -127.03 | 4 | 2 | 2 | 32 | 290.476 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.13 | 7.02 | -3.72 | 2 | 2 | 0 | 29 | 288.46 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.13 | 7.3 | -50.84 | 3 | 2 | 1 | 31 | 289.468 | 7 | ↓ |
