| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 12th, 2009 | 19 | Yes |
Popular Name: (1S)-N-cyclopentyl-1-(2,4-dimethylphenyl)-N-ethyl-ethane-1,2-diamine (1S)-N-cyclopentyl-1-(2,4-dimeth…
| 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) | 3.33 | 7.99 | -121.1 | 4 | 2 | 2 | 32 | 262.441 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.33 | 7.84 | -29.18 | 3 | 2 | 1 | 30 | 261.433 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.33 | 6.97 | -47.23 | 3 | 2 | 1 | 31 | 261.433 | 5 | ↓ |
