dCBP-1（CAS号：2484739-25-3）

FC([H])(C1=C(C2C([H])=NN(C([H])([H])[H])C=2[H])C([H])=C2C([H])([H])C([H])([H])C([H])([H])N(C2=C1[H])C1C2C([H])([H])N(C(N([H])C([H])([H])[H])=O)C([H])([H])C([H])([H])C=2N(C2([H])C([H])([H])C([H])([H])N(C(C([H])([H])C([H])([H])OC([H])([H])C([H])([H])OC([H])([H])C([H])([H])OC([H])([H])C([H])([H])OC([H])([H])C([H])([H])N([H])C3C([H])=C([H])C4=C(C=3[H])C(N(C4=O)C3([H])C(N([H])C(C([H])([H])C3([H])[H])=O)=O)=O)=O)C([H])([H])C2([H])[H])N=1)F

InChI

1S/C51H63F2N11O10/c1-54-51(70)61-17-11-41-40(31-61)47(62-14-3-4-32-26-37(33-29-56-59(2)30-33)38(46(52)53)28-43(32)62)58-64(41)35-9-15-60(16-10-35)45(66)12-18-71-20-22-73-24-25-74-23-21-72-19-13-55-34-5-6-36-39(27-34)50(69)63(49(36)68)42-7-8-44(65)57-48(42)67/h5-6,26-30,35,42,46,55H,3-4,7-25,31H2,1-2H3,(H,54,70)(H,57,65,67)

InChIKey

ILVRLRGBSSFKIE-UHFFFAOYSA-N

LogP

4.136300000000006

拓扑极性表面积

224.02999999999997 Ų

氢键供体/受体

3 / 21

复杂度

1960