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 of 2794
Records 50861 to 50880 of 55865
 
PUBCHEM ID
UNII
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Total Surface Area
Relative PSA
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
73415784 8D42TA2T6V mol2, pdbqt 281,08 0,23025 89,05 -3,351 336,491 3,6876 5 1 0 -31,692 0,385620203132751
73415786 E9L1NA800E mol2, pdbqt 59,88 0,69155 63,32 -0,028 75,0667 -3,3504 3 2 0 -1,6721 0,345157131760071
73415787 J2KA067N9O mol2, pdbqt 214,98 0,12159 37,3 -3,699 228,374 5,1537 2 1 1 -25,216 0,115300600793247
73415788 PMA59A699X mol2, pdbqt 632,98 0,34516 295,53 -4,417 774,01 -3,069 17 11 3 -22,396 0,21257041815371
73415795 8C15XFK30P mol2, pdbqt 248,11 0,15163 45,59 -3,097 324,423 2,6104 4 1 0 0,87864 0,722965631598309
73415798 BR1SN1JS2W mol2, pdbqt 904,72 0,36812 457,8 -8,127 1271,44 -0,9633 27 10 3 -27,687 0,130096272702784
73415808 DL6OZ476V3 mol2, pdbqt 101,76 0,79442 120,72 0,324 148,07 -6,8622 6 2 0 -0,34366 0,700646712078529
73415814 T8281IVO8L mol2, pdbqt 398,52 0,39664 198,28 2,646 507,539 -8,705 15 5 2 -3,04 0,386118377865866
73415815 7V4KUP966U mol2, pdbqt 52,28 1 74,6 2,01 161,952 0,6634 4 2 0 -3,8675 0,321540997053733
73415816 6915G2PQI0 mol2, pdbqt 147,86 0,66644 136,68 2,502 221,956 -3,231 8 5 0 -9,0805 0,393016168560849
73415825 42QO5P0NLM mol2, pdbqt 248,11 0,15163 45,59 -3,097 324,423 2,6104 4 1 0 0,87864 0,722965631598309
73415827 DD5FO1WKFU mol2, pdbqt 54,78 1 82,98 1,524 98,0779 -3,4103 4 2 0 -2,0209 7,20337002000834E-02
73415829 324Y4038G2 mol2, pdbqt 56,83 1 61,97 -0,482 65,0278 -0,5355 4 3 0 -4,169 0,502529466852789
73415843 AM2V8LQG5X mol2, pdbqt 1079,6 0,40254 556,17 -5,87 1408,69 -7,9679 33 17 3 2,6518 0,313152850022607
73415850 QNV480LDK2 mol2, pdbqt 539,33 0,25977 203,85 -2,501 749,904 -0,4324 11 3 2 -7,646 7,24318654732533E-02
73415851 7D841YH5S9 mol2, pdbqt 539,33 0,25977 203,85 -2,501 749,904 -0,4324 11 3 2 -8,3521 7,24143540952364E-02
73415869 W291NWW1C0 mol2, pdbqt 449,16 0,30615 181,24 -5,136 610,665 2,8289 11 5 2 -0,73382 0,278514849153411
73415938 V74TEQ36CO mol2, pdbqt 242,96 0,19616 61,72 -2,766 301,385 2,1739 4 3 0 3,2112 0,521277670130684
73415940 GN85R70NZ0 mol2, pdbqt 639,52 0,1443 111,52 -8,881 723,084 12,813 8 2 2 -31,217 6,78935348212595E-02
73415941 3A10B1F27E mol2, pdbqt 639,52 0,1443 111,52 -8,881 723,084 12,813 8 2 2 -34,156 6,78935348212577E-02
These data are only available for scientific research purposes.