UCSF

ZINC44830121

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2010 24 Yes

Popular Name: (4-Aminophenyl)(2-methyl-4,5-dihydrobenzo[b]imidazo[4,5-d]azepin-6(1H)-yl)methanone (4-Aminophenyl)(2-methyl-4,5-dih…

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CAS Number: 182202-75-1

Other Names:

MFCD16036304

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) 2.13 7.37 -35.88 4 5 1 76 319.388 1 ↓
Mid Mid (pH 6-8) 2.13 6.95 -15.17 3 5 0 75 318.38 1 ↓

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