In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 14th, 2014 | 23 | Yes |
Popular Name: tert-Butyl(14-amino-3,6,9,12-tetraoxatetradecyl)carbamate tert-Butyl(14-amino-3,6,9,12-tet…
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CAS Number: 811442-84-9
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) | -1.06 | 3.01 | -84.35 | 3 | 8 | 0 | 108 | 336.429 | 15 | ↓ |
Hi High (pH 8-9.5) | -1.06 | 2.43 | -59.77 | 2 | 8 | -1 | 106 | 335.421 | 15 | ↓ |
Lo Low (pH 4.5-6) | -1.06 | 1.27 | -49.22 | 4 | 8 | 1 | 105 | 337.437 | 15 | ↓ |
No pre-computed analogs available. Try a structural similarity search.