UCSF

ZINC03133697

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2004 23 Yes

Popular Name: 1-(4-chlorophenyl)-2-phenyl-1,5,6,7-tetrahydro-4H-indol-4-one 1-(4-chlorophenyl)-2-phenyl-1,5,…

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CAS Number: 338979-36-5

Other Names:

MFCD00232416

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) 4.82 2.1 -9.86 0 2 0 22 321.807 2 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 194 - 196 KeyOrganics

Activity (Go SEA)

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