UCSF

ZINC37867971

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 13th, 2009 15 No

Popular Name: 2-amino-N-methyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide 2-amino-N-methyl-5,6,7,8-tetrahy…

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CAS Number: 301321-97-1

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) 1.78 2.96 -11.96 2 3 0 53 224.329 1 ↓
Mid Mid (pH 6-8) 2.01 2.59 -8.92 3 3 0 55 224.329 1 ↓
Mid Mid (pH 6-8) 1.78 2.97 -12.4 2 3 0 53 224.329 1 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem

Activity (Go SEA)

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