UCSF

ZINC31555389

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2009 20 Yes

Popular Name: 3-Methyl-1-phenyl-1,2,3,4-tetrahydro-beta-carboline hydrochloride; 9H-Pyrido(3,4-b)indole, 1,2,3,4-tetrahydro-3-methyl-1-phenyl-, hydrochloride; LS-133713 3-Methyl-1-phenyl-1,2,3,4-tetrah…

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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) 4.03 7.45 -4.64 2 2 0 28 262.356 1 ↓
Mid Mid (pH 6-8) 4.03 8.67 -40.56 3 2 1 32 263.364 1 ↓

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

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