UCSF

ZINC00083644

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 15 Yes

Popular Name: 6-methyl-2,3,4,9-tetrahydro-1H-beta-carbolin-1-one 6-methyl-2,3,4,9-tetrahydro-1H-b…

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CAS Number: 3464-82-2

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) 1.99 3.55 -9.61 2 3 0 45 200.241 0 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 186 - 188 KeyOrganics

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