Binder Information
| Binder General Information | Top | |||
|---|---|---|---|---|
| Binder ID |
BD4RL7
|
|||
| Binder Name |
(S)-5-(2-((S)-1-((S)-1-((S)-1-((S)-2-(((S)-5-Amino-1-((S)-2-carbamoylpyrrolidin-1-yl)-1,5-dioxopentan-2-yl)carbamoyl)pyrrolidin-1-yl)-5-amino-1,5-dioxopentan-2-ylamino)-1-oxo-3-(4-(phosphonomethyl)phenyl)propan-2-ylamino)-5-amino-1,5-dioxopentan-2-ylamino)-2-oxoethylamino)-4-((2S,3R)-2-acetamido-3-hydroxybutanamido)-5-oxopentanoic acid
|
|||
| Synonyms |
CHEMBL248431; BDBM50233479
Click to Show/Hide
|
|||
| Binder Type |
Small molecular drug
|
|||
| Structure |
 |
Download2D MOL
|
||
| Formula |
C48H72N13O19P
|
|||
| Canonical SMILES |
C[C@H]([C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC1=CC=C(C=C1)CP(=O)(O)O)C(=O)N[C@@H](CCC(=O)N)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCC(=O)N)C(=O)N3CCC[C@H]3C(=O)N)NC(=O)C)O
|
|||
| InChI |
1S/C48H72N13O19P/c1-24(62)40(54-25(2)63)46(75)56-28(14-18-39(68)69)42(71)53-22-38(67)55-29(11-15-35(49)64)43(72)59-32(21-26-7-9-27(10-8-26)23-81(78,79)80)44(73)57-30(12-16-36(50)65)48(77)61-20-4-6-34(61)45(74)58-31(13-17-37(51)66)47(76)60-19-3-5-33(60)41(52)70/h7-10,24,28-34,40,62H,3-6,11-23H2,1-2H3,(H2,49,64)(H2,50,65)(H2,51,66)(H2,52,70)(H,53,71)(H,54,63)(H,55,67)(H,56,75)(H,57,73)(H,58,74)(H,59,72)(H,68,69)(H2,78,79,80)/t24-,28+,29+,30+,31+,32+,33+,34+,40+/m1/s1
|
|||
| InChIKey |
FJZRJYACBIDHPC-UZYGTPMGSA-N
|
|||
| PubChem Compound ID | ||||
If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.