Compound - Results

Desirudin

Java required.


Information Structure
Name Desirudin
Synonyms
63-Desulfohirudin (Hirudo Medicinalis Isoform HV1)
CGP 39393
Desirudin
Iprivask
ATC B01AX02
B01AE06
B01AE01
CID 16129703
CAS 120993535
TTD Drug ID DNC000730
SMILES CC[C@H](C)[C@@H]1NC(=O)[C@@H]2CSSC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]3CSSC[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@@H](NC(=O)[C@H](CC4=CC=C(O)C=C4)NC(=O)[C@@H](NC(=O)[C@@H](N)C(C)C)C(C)C)[C@@H](C)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N3)C(=O)N[C@@H](CCC(O)=O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CSSC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(O)=O)NC(=O)CNC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC1=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)NCC(=O)N[C@@H](CCC(O)=O)C(=O)NCC(=O)N[C@@H]([C@@H](C)O)C(=O)N5CCC[C@H]5C(=O)N[C@@H](CCCCN)C(=O)N6CCC[C@H]6C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC7=CN=CN7)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(O)=O)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC8=CC=CC=C8)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N9CCC[C@H]9C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC%10=CC=C(O)C=C%10)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(O)=O)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N2
Lepirudin

Java required.


Information Structure
Name lepirudin
Synonyms
1-l-leucine-2-l-threonine-63-desulfohirudin (hirudo Medicinalis Isoform Hv1)
1-leu-2-thr-63-desulfohirudin
138068-37-8
151126-32-8
187887-46-3
196078-30-5
ac 0137
ac0137
amylin (human) , 25-l-proline-28-l-proline-29-l-proline-
aventis Behring Brand Of Lepirudin
aventis Brand Lepirudin
aventis Pharma Brand Of Lepirudin
berlex Brand Of Lepirudin
c083544
hbw 023
hbw-023
hirudin (hirudo Medicinalis Isoform Hv1), 1-l-leucine-2-l-threonine-63-desulfo-
hoechst Brand Of Lepirudin
l-tyrosinamide, L-lysyl-l-cysteinyl-l-asparaginyl-l-threonyl-l-alanyl-l-threonyl-l-cysteinyl-l-alanyl-l-threonyl-l-glutaminyl-l-arginyl-l-leucyl-l-ala
lepirudin
lepirudin Recombinant
ls-181996
ls-186968
ls-187612
ls-188084
pharmion Brand Of Lepirudin
pramlintide
pramlintide Acetate
pramlintide Acetate Hydrate
pramlintide Acetate [usan]
pramlintide [usan]
refludan
refludin
schering Brand Of Lepirudin
symlin
triproamylin
unii-726i6te06g
unii-d3fm8fa78t
unii-y43gf64r34
ATC B01AE02
CID 16132441
CAS cid16132441
TTD Drug ID DAP000541
Extrarenal fraction 0.02
Elimination half-life 1.3h
Argatroban

Java required.


Information Structure
Name Argatroban
Synonyms
Argatroban
Argatrobanum
ATC B01AE03
CID 152951
CAS 074863846
Drugbank ID DB00278
TTD Drug ID DAP000758
SMILES C[C@@H]1CCN([C@H](C1)C(O)=O)C(=O)[C@H](CCCNC(N)=N)NS(=O)(=O)C2=C3NC[C@@H](C)CC3=CC=C2
Formula C23H36N6O5S
Molweight 508.634
Atoms 39
LogP 3.6511
Rotatable Bonds 10
H-Bond Donors 0
H-Bond Acceptors 10
CYP interactions
NameRelationsReferences
3A4Substrate 10234600
3A5Substrate 10234600
Phase2 interactions
NameReferences
MET 12361198
Extrarenal fraction 0.84
Elimination half-life 52.0min
Melagatran

Java required.


Information Structure
Name Melagatran
Synonyms
Melagatran
N-((R)-(((2S)-2-((-p-Amidobenzyl)carbamoyl)-1-azetidinyl)carbonyl)cyclohexylmethyl)glycine
ATC B01AE04
CID 183797
CAS 159776702
SMILES NC(=N)C1=CC=C(CNC(=O)[C@@H]2CCN2C(=O)[C@H](NCC(O)=O)[C@H]3CCCCC3)C=C1
Formula C22H31N5O4
Molweight 429.513
Atoms 34
LogP 2.3306
Rotatable Bonds 11
H-Bond Donors 1
H-Bond Acceptors 8
Ximelagatran

Java required.


Information Structure
Name Ximelagatran
Synonyms
Exanta
H 376/95
Ximelagatran
ATC B01AE05
CID 9574101
CAS 192939461
Drugbank ID DB04898
TTD Drug ID DNC000722
SMILES CCOC(=O)CN[C@H]([C@H]1CCCCC1)C(=O)N2CC[C@H]2C(=O)NCC3=CC=C(C=C3)C=NNO
Formula C24H35N5O5
Molweight 473.565
Atoms 34
LogP 2.5198
Rotatable Bonds 13
H-Bond Donors 0
H-Bond Acceptors 9
CYP interactions
NameRelationsReferences
2C9Substrate 16372822
Dabigatran Etexilate

Java required.


Information Structure
Name dabigatran etexilate
Synonyms
211915-06-9
bibr-1048, Dabigatran Etexilate, Bibr1048
cid9578572
d07144
dabigatran Etexilate
dabigatran Etexilate (usan/inn)
dabigatran Etexilate [inn]
Dagigatran Etexilate
ethyl 3-(((2-(((4-((((hexyloxy)carbonyl)amino)iminomethyl)phenyl)amino)methyl)-1-methyl-1h-benzimidazol-5-yl)carbonyl)(pyridin-2-yl)amino)propanoate
pradaxa
pradaxa (tn)
s2154_selleck
ATC B01AE07
CID 9578572
CAS cid9578572
TTD Drug ID DNC000318
Formula C24H35N5O5
Molweight 473.565
Atoms 34
LogP 2.5198
Rotatable Bonds 13
H-Bond Donors 0
H-Bond Acceptors 9
Extrarenal fraction 0.2
Elimination half-life 12.0h