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P2B

Summary
Name:3-[2-morpholin-4-yl-6-(pyridin-3-ylamino)pyrimidin-4-yl]phenol
Formula:C19 H19 N5 O2
Formal charge:0
Formula weight:349.386 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.013-[2-(morpholin-4-yl)-6-(pyridin-3-ylamino)pyrimidin-4-yl]phenol
OpenEye OEToolkits1.7.03-[2-morpholin-4-yl-6-(pyridin-3-ylamino)pyrimidin-4-yl]phenol

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01n2c(Nc1cccnc1)cc(nc2N3CCOCC3)c4cccc(O)c4
SMILES_CANONICALCACTVS3.370Oc1cccc(c1)c2cc(Nc3cccnc3)nc(n2)N4CCOCC4
SMILESCACTVS3.370Oc1cccc(c1)c2cc(Nc3cccnc3)nc(n2)N4CCOCC4
SMILES_CANONICALOpenEye OEToolkits1.7.0c1cc(cc(c1)O)c2cc(nc(n2)N3CCOCC3)Nc4cccnc4
SMILESOpenEye OEToolkits1.7.0c1cc(cc(c1)O)c2cc(nc(n2)N3CCOCC3)Nc4cccnc4
InChIInChI1.03InChI=1S/C19H19N5O2/c25-16-5-1-3-14(11-16)17-12-18(21-15-4-2-6-20-13-15)23-19(22-17)24-7-9-26-10-8-24/h1-6,11-13,25H,7-10H2,(H,21,22,23)
InChIKeyInChI1.03VPAXYWZGMCIWNR-UHFFFAOYSA-N

222415

數據於2024-07-10公開中

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