In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 17 | Yes |
Popular Name: (4-cyclopropylpiperazin-1-yl)-[(2S)-2-piperidyl]methanone (4-cyclopropylpiperazin-1-yl)-[(…
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) | 0.60 | 3.63 | -36.72 | 2 | 4 | 1 | 40 | 238.355 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.60 | 2.38 | -6.45 | 1 | 4 | 0 | 36 | 237.347 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.60 | 5.82 | -90.78 | 3 | 4 | 2 | 41 | 239.363 | 2 | ↓ |