In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2008 | 19 | Yes |
Popular Name: [1-ethyl-4-(4-propylpiperazin-1-yl)-4-piperidyl]methanamine [1-ethyl-4-(4-propylpiperazin-1-…
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) | 0.78 | 5.16 | -180.64 | 5 | 4 | 3 | 40 | 271.473 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.78 | 2.84 | -32.49 | 3 | 4 | 1 | 37 | 269.457 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.78 | 3.19 | -105.71 | 4 | 4 | 2 | 39 | 270.465 | 5 | ↓ |