In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2010 | 17 | Yes |
Popular Name: 2-{1-[(2-methylpropyl)carbamoyl]piperidin-3-yl}acetic acid 2-{1-[(2-methylpropyl)carbamoyl]…
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CAS Number: 1282720-47-1
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) | 1.96 | 6.13 | -58.58 | 1 | 5 | -1 | 72 | 241.311 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.96 | 4.13 | -15.75 | 2 | 5 | 0 | 70 | 242.319 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |