In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 19 | Yes |
Popular Name: (1S,2R)-2-(4-tert-butylpiperazin-1-yl)-N-propyl-cyclopentanamine (1S,2R)-2-(4-tert-butylpiperazin…
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) | 2.97 | 8.04 | -89.51 | 3 | 3 | 2 | 24 | 269.477 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.97 | 5.91 | -31.85 | 2 | 3 | 1 | 23 | 268.469 | 5 | ↓ |