rolofylline
rolofylline
SMILES | CCCn1c(=O)c2[nH]c(C34CC5CC(CC3C5)C4)nc2n(CCC)c1=O |
InChIKey | PJBFVWGQFLYWCB-UHFFFAOYSA-N |
Chemical Properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 356.2 |
SMILES | CCCn1c(=O)c2[nH]c(C34CC5CC(CC3C5)C4)nc2n(CCC)c1=O |
InChIKey | PJBFVWGQFLYWCB-UHFFFAOYSA-N |
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 356.2 |