In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 19th, 2010 | 21 | Yes |
Popular Name: (1-PYRROLIDIN-3-YL-AZETIDIN-3-YLMETHYL)-CARBAMIC ACID BENZYL ESTER (1-PYRROLIDIN-3-YL-AZETIDIN-3-YL…
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CAS Number: 883547-63-5
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) | 1.71 | 4.27 | -43.42 | 3 | 5 | 1 | 55 | 290.387 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.71 | 5.68 | -116.44 | 4 | 5 | 2 | 59 | 291.395 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.71 | 2.8 | -42.03 | 3 | 5 | 1 | 58 | 290.387 | 6 | ↓ |