In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2005 | 16 | Yes |
Popular Name: 4-amino-2-(4-methylpiperazino)-5-pyrimidinecarbonitrile 4-amino-2-(4-methylpiperazino)-5…
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CAS Number: 103151-40-2
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) | 0.21 | 4.41 | -41.21 | 3 | 6 | 1 | 83 | 219.272 | 1 | ↓ |
Lo Low (pH 4.5-6) | 0.21 | 1.23 | -90.63 | 4 | 6 | 2 | 85 | 220.28 | 1 | ↓ |
Lo Low (pH 4.5-6) | 0.21 | 4.61 | -100.05 | 4 | 6 | 2 | 85 | 220.28 | 1 | ↓ |