| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 12th, 2009 | 21 | Yes |
Popular Name: (1S)-1-(4-tert-butylphenyl)-N-cyclopentyl-N-ethyl-ethane-1,2-diamine (1S)-1-(4-tert-butylphenyl)-N-cy…
| 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) | 4.21 | 9.33 | -119.36 | 4 | 2 | 2 | 32 | 290.495 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.21 | 7.73 | -42.32 | 3 | 2 | 1 | 31 | 289.487 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.21 | 8.96 | -27.41 | 3 | 2 | 1 | 30 | 289.487 | 6 | ↓ |
