In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2008 | 17 | Yes |
Popular Name: 7H-Pyrrolo[2,3-d]pyrimidine, 4-(4-ethyl-1-piperazinyl)- 7H-Pyrrolo[2,3-d]pyrimidine, 4-(…
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CAS Number: 91647-34-6
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) | 1.05 | 7.44 | -38.9 | 2 | 5 | 1 | 49 | 232.311 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.05 | 5.22 | -7.92 | 1 | 5 | 0 | 48 | 231.303 | 2 | ↓ |