HMDB0251545 RDKit 3D 3-(4-Methoxy-2-methylphenyl)-2,5-dimethyl-N-pentan-3-ylpyrazolo[1,5-a]pyrimid... 54 56 0 0 0 0 0 0 0 0999 V2000 -6.0097 -1.8695 0.2055 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5704 -1.4318 0.1781 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2346 -0.2969 -0.7322 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8889 1.0210 -0.4714 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3755 1.0843 -0.5613 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8509 -0.1768 -1.0790 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7771 0.1152 -0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8395 0.3890 1.1073 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7406 0.6624 1.8953 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9234 0.9489 3.3658 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4826 0.6699 1.3401 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5667 0.4058 0.0253 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6727 0.3392 -0.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0479 0.5587 -0.4374 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6714 1.7770 -0.4556 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9892 1.9001 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7330 0.8198 0.3606 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0574 0.9346 0.7567 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8157 -0.1786 1.1904 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1158 -0.4045 0.3819 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7947 -0.5299 -0.0113 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1960 -1.8966 0.0408 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2374 0.0333 -2.0956 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 -0.1368 -3.3161 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0971 -0.0802 -1.9979 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4989 0.1389 -0.7468 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5498 -1.5129 1.1048 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4859 -1.5326 -0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0363 -2.9987 0.1718 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3274 -1.2278 1.2686 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9380 -2.2934 -0.1651 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7668 -0.6298 -1.7312 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4750 1.7647 -1.2217 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6299 1.3770 0.5633 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9356 0.5883 0.2293 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7120 2.1638 -0.6588 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6815 0.6298 -1.5418 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6027 -0.3271 -2.1114 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7816 0.4068 1.6079 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9506 0.7065 3.6394 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 0.4696 3.9674 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8059 2.0587 3.4539 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0935 2.6526 -0.7911 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4713 2.8683 -0.0817 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6816 -1.0379 0.4739 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4107 -0.5436 2.1687 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8962 0.0543 1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6730 -1.2851 0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5835 -2.3700 0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5310 -2.4956 -0.8161 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0923 -1.7814 0.0841 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1071 -1.2050 -3.5723 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0623 0.3232 -3.1641 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5887 0.3804 -4.1818 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 3 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 9 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 1 0 17 20 1 0 20 21 2 0 21 22 1 0 13 23 1 0 23 24 1 0 23 25 2 0 25 26 1 0 26 7 1 0 26 12 1 0 21 14 1 0 1 27 1 0 1 28 1 0 1 29 1 0 2 30 1 0 2 31 1 0 3 32 1 0 4 33 1 0 4 34 1 0 5 35 1 0 5 36 1 0 5 37 1 0 6 38 1 0 8 39 1 0 10 40 1 0 10 41 1 0 10 42 1 0 15 43 1 0 16 44 1 0 19 45 1 0 19 46 1 0 19 47 1 0 20 48 1 0 22 49 1 0 22 50 1 0 22 51 1 0 24 52 1 0 24 53 1 0 24 54 1 0 M END