In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 19th, 2010 | 19 | Yes |
Popular Name: 3-(3-AMINOMETHYL-AZETIDIN-1-YL)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER 3-(3-AMINOMETHYL-AZETIDIN-1-YL)-…
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CAS Number: 1131622-28-0
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) | 0.83 | 1.88 | -47.58 | 3 | 5 | 1 | 60 | 270.397 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.83 | 5.01 | -113.37 | 4 | 5 | 2 | 62 | 271.405 | 4 | ↓ |