UCSF

ZINC31560725

Draw Identity 99% 90% 80% 70%

Substance Information

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

Popular Name: 1H-Pyrido(3,4-b)indole, 2,3,4,9-tetrahydro-9-methyl-1-(4-pyridinyl)-, monohydrochloride; 2,3,4,9-Tetrahydro-9-methyl-1-(4-pyridinyl)-1H-pyrido(3,4-b)indole hydrochloride; LS-133722 1H-Pyrido(3,4-b)indole, 2,3,4,9-…

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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) 2.48 6.53 -7.06 1 3 0 30 263.344 1 ↓
Mid Mid (pH 6-8) 2.48 7.83 -48.11 2 3 1 34 264.352 1 ↓

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