2-(6-{2-[cyclohexyl(methyl)amino]ethyl}-9H-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
AlkaPlorer ID: AK120116
Synonym: None
IUPAC Name: (2R,3R,4S,5R)-2-[6-[2-[cyclohexyl(methyl)amino]ethyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
Structure
SMILES: CN(CCC1=C2N=CN([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C2=NC=N1)C1CCCCC1
InChI: InChI=1S/C19H29N5O4/c1-23(12-5-3-2-4-6-12)8-7-13-15-18(21-10-20-13)24(11-22-15)19-17(27)16(26)14(9-25)28-19/h10-12,14,16-17,19,25-27H,2-9H2,1H3/t14-,16-,17-,19-/m1/s1
InChIKey: BSLBPEWTGVVIQV-KLICCBINSA-N
Source
Properties Information
Molecule Weight: 391.47200000000026
TPSA？: 116.76
MolLogP？: 0.2447999999999999
Number of H-Donors: 3
Number of H-Acceptors: 9
RingCount: 4
Activities Information
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