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CHEMBL3350190

CHEMBL3350190 structure

CAS No:
134458-77-8
Formula:
C35H55N7O7
Chemical Name:
CHEMBL3350190

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CHEMBL3350190 Basic Attributes

Molecular Weight：

685.85400

Exact Mass：

685.41629712

DSSTox ID：

DTXSID20158719

Characteristics

PSA：

232.62000

XLogP3：

4.48200

Density：

1.217g/cm3

Boiling Point：

1093.4ºC

Flash Point：

615.1ºC

Refractive Index：

1.564

Vapor Pressure：

0mmHg at 25°C

Computed Properties

Molecular Weight:685.9
XLogP3:2.5
Hydrogen Bond Donor Count:8
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:19
Exact Mass:685.41629712
Monoisotopic Mass:685.41629712
Topological Polar Surface Area:219
Heavy Atom Count:49
Complexity:1040
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of CHEMBL3350190

Basic Attributes
Characteristics
Computed Properties

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