| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 15 | Yes |
Popular Name: (1S,2R)-N1-cyclopropyl-N1-methyl-1-(5-methyl-2-thienyl)propane-1,2-diamine (1S,2R)-N1-cyclopropyl-N1-methyl…
| 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) | 1.62 | 3.96 | -39.52 | 3 | 2 | 1 | 31 | 225.381 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.62 | 5.93 | -30.01 | 3 | 2 | 1 | 30 | 225.381 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.62 | 4.14 | -1.8 | 2 | 2 | 0 | 29 | 224.373 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.62 | 6.23 | -107.82 | 4 | 2 | 2 | 32 | 226.389 | 4 | ↓ |
