UCSF

ZINC02190702

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 13th, 2004 22 Yes

Popular Name: 1-butyl-2,6,6-trimethyl-3-(2,2,2-trichloroethyl)-1,5,6,7-tetrahydro-4H-indol-4-one 1-butyl-2,6,6-trimethyl-3-(2,2,2…

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Other Names:

MFCD02933716

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) 5.70 2.28 -7.67 0 2 0 22 364.744 5 ↓

Activity (Go SEA)

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