2D5
FEATURES
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NAMES
  • 2D5
SMILES
Nc1ncnc2c1ncn2C1OC(CSCCCNC(=O)C2Cc3ccccc3CN2)C(O)C1O
InChI
InChI=1S/C23H29N7O4S/c24-20-17-21(28-11-27-20)30(12-29-17)23-19(32)18(31)16(34-23)10-35-7-3-6-25-22(33)15-8-13-4-1-2-5-14(13)9-26-15/h1-2,4-5,11-12,15-16,18-19,23,26,31-32H,3,6-10H2,(H,25,33)(H2,24,27,28)/t15-,16-,18-,19-,23-/m1/s1
MOLECULAR FORMULA
C23H29N7O4S
CROSS REFERENCES
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2D5
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight499.20
AlogP-0.02
HBond donors6
HBond acceptors11
Atoms64
Contains toxicophoreNo
Contains PAINSNo
Commercially availableUnknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by 2D5.