In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 16 | Yes |
Popular Name: (1R,2S)-2-(4-isopropylpiperazin-1-yl)-N-methyl-cyclopentanamine (1R,2S)-2-(4-isopropylpiperazin-…
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) | 1.57 | 6.21 | -89.72 | 3 | 3 | 2 | 24 | 227.396 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.57 | 3.99 | -32.39 | 2 | 3 | 1 | 23 | 226.388 | 3 | ↓ |