In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 19th, 2010 | 22 | Yes |
Popular Name: (1-PIPERIDIN-4-YL-AZETIDIN-3-YLMETHYL)-CARBAMIC ACID BENZYL ESTER (1-PIPERIDIN-4-YL-AZETIDIN-3-YLM…
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CAS Number: 883547-28-2
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) | 1.63 | 5 | -43.19 | 3 | 5 | 1 | 55 | 304.414 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.63 | 3.36 | -42.93 | 3 | 5 | 1 | 58 | 304.414 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.63 | 6.34 | -109.79 | 4 | 5 | 2 | 59 | 305.422 | 6 | ↓ |