InChI: |
1S/C51H40N6O23S6.6Na.6H/c1-25-9-11-29(49(60)54-37-13-15-41(83(69,70)71)35-21-33(81(63,64)65)23-43(45(35)37)85(75,76)77)19-39(25)56-47(58)27-5-3-7-31(17-27)52-51(62)53-32-8-4-6-28(18-32)48(59)57-40-20-30(12-10-26(40)2)50(61)55-38-14-16-42(84(72,73)74)36-22-34(82(66,67)68)24-44(46(36)38)86(78,79)80;;;;;;;;;;;;/h3-24H,1-2H3,(H,54,60)(H,55,61)(H,56,58)(H,57,59)(H2,52,53,62)(H,63,64,65)(H,66,67,68)(H,69,70,71)(H,72,73,74)(H,75,76,77)(H,78,79,80);;;;;;;;;;;; |
InChIKey: |
CPLPGXZMIAOXDA-UHFFFAOYSA-N |
|
H donor: |
6 |
H acceptor: |
29 |
Rotatable bond: |
16 |
Stereocenter: |
0 |
|
cLogP: |
-4.146 |
cLogS: |
-5.228 |
Polar surface: |
551.01 |
|