Chemotherapeutics; TerraQSAR-LOGP computed octanol/water partition coefficients (CLOGPs)

Chemotherapeutics

TerraQSAR-LOGP^TM computed octanol/water partition coefficients (CLOGPs).

For other toxicity and effect values, such as mammalian (rat/mouse) intravenous LD50, fish (fathead minnow) 96-hr LC50, estrogen receptor binding affinity (RBA), use TerraQSAR-RMIV, TerraQSAR-FHM, and TerraQSAR-E2-RBA programs, or consult TerraBase Inc.

NAME	CAS	FORMULA	MW	TerraQSAR - LOGP
alafosfalin	60668-24-8	C5H13N2O4P	196.14	-0.43
Isoniazid; isonicotinic acid hydrazide	54-85-3	C6H7N3O	137.14	-0.70
nifursemizone	5579-89-5	C8H10N4O4	226.19	0.25
nidroxyzone	405-22-1	C8H10N4O5	242.19	0.16
nitrosulfathiazole	473-42-7	C9H7N3O4S2	285.30	0.33
gemcitabine	95058-81-4	C9H15F2N3O4	267.23	-1.05
nifurvidine	1900-13-6	C11H9N3O4	247.21	0.53
nifurmazole	18857-59-5	C11H10N4O6	294.22	-0.09
temodox	34499-96-2	C12H12N2O5	264.24	-2.34
nifurpipone	24632-47-1	C12H17N5O4	295.30	0.39
maleylsulfathiazole	515-57-1	C13H11N3O5S2	353.37	1.34
nifurfoline	3363-58-4	C13H15N5O6	337.29	-0.21
nifuroquine	57474-29-0	C14H8N2O6	300.23	0.16
sulfacecole	21662-79-3	C14H17N3O5S	339.37	0.96
sulfaclorazole	54063-55-7	C16H15ClN4O2S	362.84	0.96
tetroxoprim	53808-87-0	C16H22N4O4	334.38	0.91
ondansetron [99614-02-5]	116002-70-1	C18H19N3O	293.37	1.74
alexidine	22573-93-9	C26H56N10	508.80	-0.83