Chemical ID: 5254670

C1C=CN(C(=O)N1CO)CO
Chemical ID:
5254670
Name [?]:
1,3-bis(hydroxymethyl)-4H-pyrimidin-2-one
SMILES [?]:
C1C=CN(C(=O)N1CO)CO
InChi [?]:
InChI=1/C6H10N2O3/c9-4-7-2-1-3-8(5-10)6(7)11/h1-2,9-10H,3-5H2
InChi Info:
AuxInfo=1/0/N:2,3,1,10,8,5,4,7,11,9,6/rA:11nCCCNCONCOCO/rB:s1;d2;s3;s4;d5;s1s5;s7;s8;s4;s10;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C6H10N2O3
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:2.87921
Area:308.599
Solvation:-4.83577
Coulombic:-56.0507
Bond Count [?]
All:11
Single:9
Double:2
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:158.155
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:-1.28
LogP (Chemaxon):-0.26

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Descriptor Annotations

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