General Information of the Compound
| Compound ID |
CP0047122
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| Compound Name |
N-(diaminomethylidene)-2-methyl-5-methylsulfonyl-4-pyrrol-1-ylbenzamide
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| Synonyms |
176644-21-6
7IGF9182QU
9260AA
AC1O5FJV
AJ-64172
AK-61121
AKOS016007503
AKOS024262733
ANW-71932
BCP09780
BDBM50058715
C14H16N4O3S
CHEMBL64360
CTK8C4436
CZC25146
DS-16493
EMD-96785
ENIPORIDE
EX-A1476
Eniporide
Eniporide [INN]
Eniporide(EMD96785)
KS-00000IZ2
MolPort-035-675-643
N-(Diaminomethylene)
N-(diaminomethylene)-2-methyl-5-(methylsulfonyl)-4-(1H-pyrrol-1-yl)benzamide
N-Carbamimidoyl-2-methyl-5-(methylsulfonyl)-4-(1H-pyrrol-1-yl)benzamide
SCHEMBL6619621
UADMBZFZZOBWBB-UHFFFAOYSA-N
UNII-7IGF9182QU
ZINC13555902
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| Structure |
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| Formula |
C14H16N4O3S
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| Molecular Weight |
320.374
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| Canonical SMILES |
Cc1cc(c(cc1C(=O)NC(N)=N)S(C)(=O)=O)-n1cccc1
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| InChI |
InChI=1S/C14H16N4O3S/c1-9-7-11(18-5-3-4-6-18)12(22(2,20)21)8-10(9)13(19)17-14(15)16/h3-8H,1-2H3,(H4,15,16,17,19)
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| InChIKey |
UADMBZFZZOBWBB-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT03805, Sodium/hydrogen exchanger 1
Protein ID: PT04308, Sodium/hydrogen exchanger 2
Protein ID: PT03762, Sodium/hydrogen exchanger 3
Protein ID: PT02731, Sodium/hydrogen exchanger 5
Clinical Information about the Compound