In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2008 | 22 | Yes |
Popular Name: 3-cyclopentyl-1-[4-(4-methylpiperazin-1-yl)-1-piperidyl]propan-1-one 3-cyclopentyl-1-[4-(4-methylpipe…
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) | 2.30 | 8.28 | -42.64 | 1 | 4 | 1 | 28 | 308.49 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.30 | 5.8 | -7.31 | 0 | 4 | 0 | 27 | 307.482 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.30 | 8.08 | -43.59 | 1 | 4 | 1 | 28 | 308.49 | 4 | ↓ |