24823177 -OEChem-05042416532D 61 64 0 1 0 0 0 0 0999 V2000 4.5981 -1.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 1.1550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.8564 0.1550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.3450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.3450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.3450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.1550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 -0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8564 1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7224 -0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.3450 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4641 0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5138 0.2627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9123 -0.4276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3889 2.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5919 2.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5919 -0.8199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3889 -0.8199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4670 1.0473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0685 1.7376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6569 2.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8598 2.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4124 -0.8819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2594 -0.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0324 0.1919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 -0.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 2.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -0.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1233 1.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8626 0.6299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0656 0.6299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 1.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -1.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 1 57 1 0 0 0 0 2 8 1 0 0 0 0 2 9 1 0 0 0 0 2 12 1 0 0 0 0 3 10 1 0 0 0 0 3 11 1 0 0 0 0 3 13 1 0 0 0 0 4 19 1 0 0 0 0 4 23 1 0 0 0 0 4 49 1 0 0 0 0 5 21 1 0 0 0 0 5 24 1 0 0 0 0 5 53 1 0 0 0 0 6 23 1 0 0 0 0 6 24 2 0 0 0 0 7 23 2 0 0 0 0 7 30 1 0 0 0 0 8 10 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 11 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 14 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 15 17 1 0 0 0 0 15 45 1 0 0 0 0 16 18 2 0 0 0 0 16 46 1 0 0 0 0 17 19 2 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 50 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 25 2 0 0 0 0 22 26 1 0 0 0 0 24 27 1 0 0 0 0 25 28 1 0 0 0 0 25 54 1 0 0 0 0 26 29 2 0 0 0 0 26 55 1 0 0 0 0 27 30 2 0 0 0 0 27 56 1 0 0 0 0 28 31 2 0 0 0 0 28 58 1 0 0 0 0 29 31 1 0 0 0 0 29 59 1 0 0 0 0 30 60 1 0 0 0 0 31 61 1 0 0 0 0 M END > 24823177 > 1 > 500 > 7 > 3 > 8 > AAADceB7oAAAAAAAAAAAAAAAAAAAAAAAAAA8eIEAAAAAAAAB0AAAHgAQCAAADBzhmgY/8JfIEgCgAjZnZACCgCkxAqAJ2KA4bJiKfqLA2dGUdAhs0APY2CeQwKAOCAAAAAAAAAAQAAAAAAAAAAAAAAAAAA== > 2-[[2-[4-[(4-methylpiperazin-1-yl)methyl]anilino]pyrimidin-4-yl]amino]-1-phenyl-ethanol > 2-[[2-[4-[(4-methyl-1-piperazinyl)methyl]anilino]-4-pyrimidinyl]amino]-1-phenylethanol > 2-[[2-[4-[(4-methylpiperazin-1-yl)methyl]anilino]pyrimidin-4-yl]amino]-1-phenylethanol > 2-[[2-[4-[(4-methylpiperazin-1-yl)methyl]anilino]pyrimidin-4-yl]amino]-1-phenylethanol > 2-[[2-[[4-[(4-methylpiperazin-1-yl)methyl]phenyl]amino]pyrimidin-4-yl]amino]-1-phenyl-ethanol > 2-[[2-[4-[(4-methylpiperazino)methyl]anilino]pyrimidin-4-yl]amino]-1-phenyl-ethanol > InChI=1S/C24H30N6O/c1-29-13-15-30(16-14-29)18-19-7-9-21(10-8-19)27-24-25-12-11-23(28-24)26-17-22(31)20-5-3-2-4-6-20/h2-12,22,31H,13-18H2,1H3,(H2,25,26,27,28) > MOMBHYGOFWYZEM-UHFFFAOYSA-N > 2.9 > 418.24810960 > C24H30N6O > 418.5 > CN1CCN(CC1)CC2=CC=C(C=C2)NC3=NC=CC(=N3)NCC(C4=CC=CC=C4)O > CN1CCN(CC1)CC2=CC=C(C=C2)NC3=NC=CC(=N3)NCC(C4=CC=CC=C4)O > 76.6 > 418.24810960 > 0 > 31 > 0 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 20 1 3 14 15 8 14 16 8 15 17 8 16 18 8 17 19 8 18 19 8 22 25 8 22 26 8 24 27 8 25 28 8 26 29 8 27 30 8 28 31 8 29 31 8 6 23 8 6 24 8 7 23 8 7 30 8 $$$$