Microsource Spectrum01501155

S(=O)(=O)(Nc1ncc(cn1)OC)c1ccc(N)cc1	01501155
InChI=1/C11H12N4O3S/c1-18-9-6-13-11(14-7-9)15-19(16,17)10-4-2-8(12)3-5-10/h2-7H,12H2,1H3,(H,13,14,15)/f/h15H
To be implemented TODO
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LibraryMicrosource Spectrum
ID01501155
NameSULFAMETER
FormulaC11H12N4O3S
Molecular Weight280.303

Physicochemical Properties
ACG 0
AOH 0
ARB 12
AT 19.000
AlogP98 0.297
B 0
BAG 0
BIC 0.577
BON 20
Br 0
CHI-0 13.880
CHI-1 9.009
CHI-2 8.445
CHI-3_C 1.892
CHI-3_CH 0
CHI-3_P 6.479
CHI-V-0 10.885
CHI-V-1 6.738
CHI-V-2 5.303
CHI-V-3_C 0.873
CHI-V-3_CH 0
CHI-V-3_P 3.624
CIC 1.474
Cl 0
E-ADJ-mag 325.212
E-DIST-mag 3326.327
F 0
FRB 0.200
GDI 6.522
GRA 0.688
HA1 7.000
HA2 7.000
HAL 0
HD1 2
HD2 1.000
Hbond acceptor 5.000
Hbond donor 3.000
I 0
IAC-Total 59.752
IC 2.774
JX 2.070
KS1 15.390
KS2 6.635
Kappa-1 15.390
Kappa-1-AM 13.247
Kappa-2 6.635
Kappa-2-AM 5.206
Kappa-3 4.231
Kappa-3-AM 3.176
LGP 1.949
MR 70.291
N 4
NO2 0
O 3.000
OSO 0
P 0
PHI 3.629
POL 115.580
ROT 4
Rotlbonds 4
S 1.000
SC-0 19.000
SC-1 20
SC-2 28
SC-3_C 8
SC-3_CH 0
SC-3_P 33.000
SIC 0.653
SO 0
SO2 2
TDI 12
TRA 1.000
V-ADJ-mag 212.877
V-DIST-mag 2949.560
Wiener 758
ZI1 96
Zagreb 96
Sample Information
therap antibacterial
source synthetic
cas# 651-06-9
weight 280.30298
position G08

Relevant Screens

Screen ID Screen Name Compound Activity
161 Trafficking Pathways in Root Tip no information

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