HIT ID: HIT212710175
Cas No: 1088-80-8
分子式: C13H18Cl2N2O2
分子量: 305.2
常用名: Metamelfalan
氢键受体数 (HBA): 4
氢键供体数 (HBD): 2
LogP: 0.25249046
IUPAC: (2S)-2-amino-3-{3-[bis(2-chloroethyl)amino]phenyl}propanoic acid
IUPAC: (2S)-2-amino-3-{3-[bis(2-chloroethyl)amino]phenyl}propanoic acid
SMILES: N[C@@H](Cc1cccc(c1)N(CCCl)CCCl)C(O)=O
SMILES: N[C@@H](Cc1cccc(c1)N(CCCl)CCCl)C(O)=O
InChI key: QDGAVODICPCDMU-LBPRGKRZSA-N