| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 18 | Yes |
Popular Name: (1S,2S)-2-[4-(cyclopropylmethyl)piperazin-1-yl]cycloheptanamine (1S,2S)-2-[4-(cyclopropylmethyl)…
| 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) | 1.87 | 6.04 | -100.85 | 4 | 3 | 2 | 35 | 253.434 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.87 | 3.76 | -38.91 | 3 | 3 | 1 | 34 | 252.426 | 3 | ↓ |
