Payload Information
General Information of This Payload
| Payload ID | PAY0NWDDV |
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|---|---|---|---|---|---|---|
| Name | Amanitin |
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| Synonyms |
Amanitin
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| Target | RNA polymerase II | |||||
| Formula | C39H53N9O14S |
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| Isosmiles | CCC(C)C1C(=O)NCC(=O)NC2CSC3=C(CC(C(=O)NCC(=O)N1)NC(=O)C(NC(=O)C4CC(CN4C(=O)C(NC2=O)CC(=O)O)O)C(C)C(CO)O)C5=C(N3)C=C(C=C5)O |
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| PubChem CID | ||||||
| InChI |
InChI=1S/C39H53N9O14S/c1-4-16(2)31-36(60)41-11-28(53)42-25-15-63-38-21(20-6-5-18(50)7-22(20)45-38)9-23(33(57)40-12-29(54)46-31)43-37(61)32(17(3)27(52)14-49)47-35(59)26-8-19(51)13-48(26)39(62)24(10-30(55)56)44-34(25)58/h5-7,16-17,19,23-27,31-32,45,49-52H,4,8-15H2,1-3H3,(H,40,57)(H,41,60)(H,42,53)(H,43,61)(H,44,58)(H,46,54)(H,47,59)(H,55,56)
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| InChIKey |
RUDNHCHNENLLKM-UHFFFAOYSA-N
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| Pharmaceutical Properties | Molecule Weight |
903.969 |
Polar area |
358.02 |
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Complexity |
2029.250193 |
xlogp Value |
-4.3364 |
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Heavy Count |
63 |
Rot Bonds |
7 |
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Hbond acc |
14 |
Hbond Donor |
13 |
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Each Antibody-drug Conjugate Related to This Payload