In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 19th, 2010 | 25 | Yes |
Popular Name: 1-(2-carboxyphenylmethyl)-3-ethyl-4-Boc piperazine 1-(2-carboxyphenylmethyl)-3-ethy…
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CAS Number: 1131622-99-5
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) | 3.06 | 9.02 | -49.27 | 0 | 6 | -1 | 73 | 347.435 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.06 | 10.57 | -38.07 | 1 | 6 | 0 | 74 | 348.443 | 6 | ↓ |