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Structure

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Synonyms:

6-((4-chlorobenzyl)thio)-9-propyl-9H-purin-2-amine (ACD/Name)
6-((4-chlorobenzyl)thio)-9-propyl-9H-purin-2-ylamine (ACD/Name)

Smile:

n1c(SCc2ccc(Cl)cc2)c2ncn(c2nc1N)CCC

Cas:

92494-54-7

NSC:

43414

Formula:

C15H16ClN5S

Rings:

3

Atoms:

38

Weight:

333.839

H-Donors:

1

H-Acceptor:

6

Rotatable Bonds:

5

NCI-H23

Cellline Tox Value Tox Type Cellline Tox Value Tox Type Cellline Tox Value Tox Type
NCI-H23 4 nlog(LC50) A549/ATCC 4 nlog(LC50) EKVX 4 nlog(LC50)
NCI-H322M 4 nlog(LC50) HOP-62 4 nlog(LC50) HOP-92 4 nlog(LC50)
HCC-2998 4 nlog(LC50) HCT-116 4 nlog(LC50) SW-620 4 nlog(LC50)
HCT-15 4 nlog(LC50) KM12 4 nlog(LC50) MCF7 4 nlog(LC50)
NCI/ADR-RES 4 nlog(LC50) MDA-MB-231/ATCC 4 nlog(LC50) Hs 578T 4 nlog(LC50)
MDA-MB-435 4 nlog(LC50) MDA-N 4 nlog(LC50) BT-549 4 nlog(LC50)
T-47D 4 nlog(LC50) OVCAR-4 4 nlog(LC50) OVCAR-5 4 nlog(LC50)
OVCAR-8 4 nlog(LC50) IGROV1 4 nlog(LC50) SK-OV-3 4 nlog(LC50)
CCRF-CEM 4 nlog(LC50) K-562 4 nlog(LC50) HL-60(TB) 4 nlog(LC50)
RPMI-8226 4 nlog(LC50) UO-31 4 nlog(LC50) SN12C 4 nlog(LC50)
A498 4 nlog(LC50) CAKI-1 4 nlog(LC50) RXF 393 4 nlog(LC50)
786-0 4 nlog(LC50) TK-10 4 nlog(LC50) LOX IMVI 4 nlog(LC50)
Malme-3M 4 nlog(LC50) SK-MEL-28 4 nlog(LC50) M14 4 nlog(LC50)
UACC-62 4 nlog(LC50) PC-3 4 nlog(LC50) DU-145 4 nlog(LC50)
SNB-19 4 nlog(LC50) SNB-75 4 nlog(LC50) U251 4 nlog(LC50)
SF-268 4 nlog(LC50) OVCAR-3 4.005 nlog(LC50) SF-295 4.01 nlog(LC50)
HT29 4.022 nlog(LC50) UACC-257 4.027 nlog(LC50) SK-MEL-2 4.033 nlog(LC50)
SR 4.047 nlog(LC50) NCI-H460 4.054 nlog(LC50) NCI-H522 4.082 nlog(LC50)
SK-MEL-5 4.138 nlog(LC50) ACHN 4.152 nlog(LC50)

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