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Records 41 to 60 of 321
 
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TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
120944-03-8 kin-120944-03-8.mol2, kin-120944-03-8.pdbqt 133,47 -5,421 454,367 2,3551 10 0 0 -27,16 0,220531033620064
121263-19-2 kin-121263-19-2.mol2, kin-121263-19-2.pdbqt 66,9 -0,964 154,121 -0,8496 4 1 0 1,2066 0,521468480274144
121-40-4 kin-121-40-4.mol2, kin-121-40-4.pdbqt 193,58 -9,956 790,772 7,681 14 3 3 -0,26929 2,13447579819833E-02
1217486-61-7 kin-1217486-61-7.mol2, kin-1217486-61-7.pdbqt 129,45 -5,727 441,477 3,8412 7 2 0 -0,75604 0,192797853742434
1219168-18-9 kin-1219168-18-9.mol2, kin-1219168-18-9.pdbqt 55,55 -5,212 399,497 2,6426 6 0 0 4,8443 0,366097686211821
122520-85-8 kin-122520-85-8.mol2, kin-122520-85-8.pdbqt 107,34 -1,755 204,185 0,2367 5 3 0 -3,1609 0,401050619049457
122520-86-9 kin-122520-86-9.mol2, kin-122520-86-9.pdbqt 125,91 -2,791 220,252 0,4163 4 2 0 -5,4975 0,466797289414947
122520-90-5 kin-122520-90-5.mol2, kin-122520-90-5.pdbqt 158,08 -2,647 268,232 0,7548 7 4 0 -9,083 0,461111167780747
123-78-4 kin-123-78-4.mol2, kin-123-78-4.pdbqt 66,48 -3,847 299,497 4,6273 3 3 0 -25,157 0,335789822536746
1246094-78-9 kin-1246094-78-9.mol2, kin-1246094-78-9.pdbqt 124,49 -5,206 362,428 2,2935 6 4 0 3,0816 0,504829717477812
125035-83-8 kin-125035-83-8.mol2, kin-125035-83-8.pdbqt 86,52 -6,898 480,523 4,61 8 2 0 4,8676 0,35009036878964
1255517-76-0 kin-1255517-76-0.mol2, kin-1255517-76-0.pdbqt 60,94 -2,841 390,412 2,7412 6 1 0 -1,4674 0,47956892456028
1256589-74-8 kin-1256589-74-8.mol2, kin-1256589-74-8.pdbqt 72,36 -6,018 482,626 4,7668 6 1 0 -0,65912 0,2564326289308
125697-92-9 kin-125697-92-9.mol2, kin-125697-92-9.pdbqt 121,46 -3,127 381,383 2,4945 7 5 0 1,6694 0,448034751522581
126643-37-6 kin-126643-37-6.mol2, kin-126643-37-6.pdbqt 74,93 -6,256 495,534 4,6985 8 0 0 2,6177 0,351574220587446
127191-97-3 kin-127191-97-3.mol2, kin-127191-97-3.pdbqt 146,84 -5,483 721,857 4,8691 11 0 2 10,972 0,281947227835126
127243-85-0 kin-127243-85-0.mol2, kin-127243-85-0.pdbqt 79,47 -4,439 446,368 3,3163 5 2 0 0,073954 0,474043071146406
12772-57-5 kin-12772-57-5.mol2, kin-12772-57-5.pdbqt 96,36 -3,667 364,78 2,7383 6 2 0 0,50998 0,381704045014701
129-56-6 kin-129-56-6.mol2, kin-129-56-6.pdbqt 45,75 -4,482 220,231 2,4774 3 1 0 1,371 0,415204702892793
129735-00-8 kin-129735-00-8.mol2, kin-129735-00-8.pdbqt 179,67 -4,094 424,171 -1,2436 10 3 0 -12,698 8,43872673383339E-02
These data are only available for scientific research purposes.