In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2011 | 20 | Yes |
Popular Name: (1S,3R)-2,2-dimethyl-3-(3-piperazin-1-ylpropylcarbamoyl)cyclopropanecarboxylic (1S,3R)-2,2-dimethyl-3-(3-pipera…
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) | -0.07 | 3.06 | -80.43 | 3 | 6 | 0 | 89 | 283.372 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.07 | 1.69 | -53.96 | 2 | 6 | -1 | 84 | 282.364 | 6 | ↓ |
Lo Low (pH 4.5-6) | -0.07 | 1.08 | -47.87 | 4 | 6 | 1 | 86 | 284.38 | 6 | ↓ |