Mrv1652305221920072D
1 0 0 0 0 0 999 V2000
0.0000 0.0000 0.0000 Cr 0 0 0 0 0 0 0 0 0 0 0 0
M END
> <DATABASE_ID>
NP0046166
> <DATABASE_NAME>
NP-MRD
> <SMILES>
[Cr]
> <INCHI_IDENTIFIER>
InChI=1S/Cr
> <INCHI_KEY>
VYZAMTAEIAYCRO-UHFFFAOYSA-N
> <FORMULA>
Cr
> <MOLECULAR_WEIGHT>
51.9961
> <EXACT_MASS>
51.940511904
> <JCHEM_ACCEPTOR_COUNT>
0
> <JCHEM_ATOM_COUNT>
1
> <JCHEM_AVERAGE_POLARIZABILITY>
1.7784
> <JCHEM_BIOAVAILABILITY>
1
> <JCHEM_DONOR_COUNT>
0
> <JCHEM_FORMAL_CHARGE>
0
> <JCHEM_GHOSE_FILTER>
0
> <JCHEM_IUPAC>
chromium
> <ALOGPS_LOGP>
-1.31
> <JCHEM_LOGP>
-0.156
> <ALOGPS_LOGS>
1.08
> <JCHEM_MDDR_LIKE_RULE>
0
> <JCHEM_NUMBER_OF_RINGS>
0
> <JCHEM_PHYSIOLOGICAL_CHARGE>
0
> <JCHEM_POLAR_SURFACE_AREA>
0.0
> <JCHEM_REFRACTIVITY>
0.0
> <JCHEM_ROTATABLE_BOND_COUNT>
0
> <JCHEM_RULE_OF_FIVE>
1
> <ALOGPS_SOLUBILITY>
0.00e+00 g/l
> <JCHEM_TRADITIONAL_IUPAC>
chromium
> <JCHEM_VEBER_RULE>
1
$$$$