In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 15 | Yes |
Popular Name: 2-{[1-(propan-2-yl)piperidin-4-yl]amino}butan-1-ol 2-{[1-(propan-2-yl)piperidin-4-y…
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CAS Number: 1038259-63-0
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) | 1.42 | 2.76 | -33.12 | 3 | 3 | 1 | 37 | 215.361 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.42 | 1.55 | -32.81 | 3 | 3 | 1 | 40 | 215.361 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.42 | 3.82 | -97.26 | 4 | 3 | 2 | 41 | 216.369 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |