UCSF

ZINC70089754

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2011 18 No

Popular Name: 2-amino-N-isopropyl-4-(3-methyl-2-thienyl)thiophene-3-carboxamide 2-amino-N-isopropyl-4-(3-methyl-…

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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) 2.23 4.84 -11.74 2 3 0 53 280.418 3 ↓
Mid Mid (pH 6-8) 2.88 4.42 -10.67 3 3 0 55 280.418 3 ↓

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

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