In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 19 | Yes |
Popular Name: (3R,5R)-N-cyclopropyl-4-(2-dimethylaminoethyl)-3,5-dimethyl-piperazine-1-carboxamide (3R,5R)-N-cyclopropyl-4-(2-dimet…
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) | 1.49 | 5.07 | -42.71 | 2 | 5 | 1 | 40 | 269.413 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.49 | 2.59 | -7.33 | 1 | 5 | 0 | 39 | 268.405 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.49 | 7.13 | -115.78 | 3 | 5 | 2 | 41 | 270.421 | 4 | ↓ |