UCSF

ZINC20612215

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 26th, 2008 33 Yes

Popular Name: 3-(2,5-dimethoxyphenyl)-6-hydroxy-5-[(1S)-2-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-1-yl]-1H-pyr 3-(2,5-dimethoxyphenyl)-6-hydrox…

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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) 2.97 6.39 -32.29 3 9 0 117 448.479 4 ↓
Hi High (pH 8-9.5) 2.97 4.43 -48.5 2 9 -1 115 447.471 4 ↓
Hi High (pH 8-9.5) 2.97 4.43 -49.42 2 9 -1 115 447.471 4 ↓

Activity (Go SEA)

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