| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2009 | 15 | Yes |
Popular Name: (1S,2S)-N1-methyl-N1-(4-pyridylmethyl)cyclopentane-1,2-diamine (1S,2S)-N1-methyl-N1-(4-pyridylm…
| 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) | 0.21 | 4.34 | -126.65 | 4 | 3 | 2 | 45 | 207.321 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.21 | 1.95 | -3.54 | 2 | 3 | 0 | 42 | 205.305 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.21 | 1.82 | -45.97 | 3 | 3 | 1 | 44 | 206.313 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.21 | 4.23 | -37.68 | 3 | 3 | 1 | 43 | 206.313 | 3 | ↓ |
