- Novel coronavirus rbd fusion protein, World Intellectual Property Organization, , ,
MDL | MFCD01310914 |
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InChIKey | HVLSXIKZNLPZJJ-TXZCQADKSA-N |
Inchi | 1S/C53H67N9O17/c1-27(2)44(52(77)62-21-5-7-41(62)50(75)59-38(25-42(66)67)47(72)56-36(45(70)55-28(3)53(78)79)23-30-10-16-33(64)17-11-30)60-48(73)39(26-43(68)69)57-46(71)37(24-31-12-18-34(65)19-13-31)58-49(74)40-6-4-20-61(40)51(76)35(54)22-29-8-14-32(63)15-9-29/h8-19,27-28,35-41,44,63-65H,4-7,20-26,54H2,1-3H3,(H,55,70)(H,56,72)(H,57,71)(H,58,74)(H,59,75)(H,60,73)(H,66,67)(H,68,69)(H,78,79)/t28-,35-,36-,37-,38-,39-,40-,41-,44-/m0/s1 |
SMILES | C(N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)CC1C=CC(O)=CC=1)(=O)[C@H](C(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC([C@@H]1CCCN1C(=O)[C@@H](N)CC1C=CC(O)=CC=1)=O)CC1C=CC(O)=CC=1 |
LogP | 1.68080 |
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PSA | 413.83000 |
沸点 | 1556.4±65.0 °C at 760 mmHg |
熔点 | No data available |
闪点 | 895.1±34.3 °C |
溶解度 | 微溶 (2.1 g/L) (25 ºC), |
颜色与性状 | No data available |
密度 | 1.414±0.06 g/cm3 (20 ºC 760 Torr), |
精确分子量 | 1101.47000 |
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氢键供体数量 | 13 |
氢键受体数量 | 26 |
可旋转化学键数量 | 34 |
重原子数量 | 79 |
PubChemId | 329815363 |
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Beilstein | MFCD01310914 |
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