In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 27th, 2005 | 16 | Yes |
Popular Name: 2-(4-methylpiperazino)-1,3-benzoxazole 2-(4-methylpiperazino)-1,3-benzo…
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CAS Number: 20128-05-6
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) | 1.85 | 5 | -43.48 | 1 | 4 | 1 | 34 | 218.28 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.85 | 2.65 | -7.68 | 0 | 4 | 0 | 33 | 217.272 | 1 | ↓ |