In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 20 | Yes |
Popular Name: 4-chloro-2-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methyl]phenol 4-chloro-2-[(2,3-dihydro-1,4-ben…
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CAS Number: [1019487-47-8]
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) | 3.30 | 3.89 | -10.24 | 2 | 4 | 0 | 51 | 291.734 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.30 | 4.68 | -39.25 | 1 | 4 | -1 | 54 | 290.726 | 3 | ↓ |