In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2004 | 16 | No |
Popular Name: N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-n-(2-chloroethyl)urea N-[(4-amino-2-methyl-5-pyrimidin…
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CAS Number: 42471-43-2
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) | -0.50 | 0.39 | -10.52 | 4 | 6 | 0 | 93 | 243.698 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.50 | 0.69 | -38.88 | 5 | 6 | 1 | 94 | 244.706 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.50 | -2.95 | -36.31 | 5 | 6 | 1 | 94 | 244.706 | 4 | ↓ |