HIT ID: HIT212077944
Cas No: 244768-47-6;244767-67-7
分子式: C20H20ClN5
分子量: 365.87
常用名: Dapivirine HCl
氢键受体数 (HBA): 5
氢键供体数 (HBD): 2
LogP: 5.5991907
IUPAC: 4-({4-[(2,4,6-trimethylphenyl)amino]pyrimidin-2-yl}amino)benzonitrile hydrochloride
IUPAC: 4-({4-[(2,4,6-trimethylphenyl)amino]pyrimidin-2-yl}amino)benzonitrile hydrochloride
SMILES: Cl.Cc1cc(C)c(Nc2ccnc(Nc3ccc(cc3)C#N)n2)c(C)c1
SMILES: Cl.Cc1cc(C)c(Nc2ccnc(Nc3ccc(cc3)C#N)n2)c(C)c1
InChI key: RHIYZDNOTUMYCA-UHFFFAOYSA-N
