UCSF

ZINC38531838

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 26th, 2010 8 No

Popular Name: 5-Chloromethyl-2,4-Dihydro-[1,2,4]Triazol-3-One 5-Chloromethyl-2,4-Dihydro-[1,2,…

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CAS Number: 252742-72-6

Other Names:

MFCD07776630

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -0.31 -1.57 -8.49 0 4 0 56 131.522 1 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.