UCSF

ZINC67975793

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2011 26 Yes

Popular Name: 3-(3,4,7-trimethyl-1H-indole-2-carbonyl)-3,7,10-triazaspiro[5.5]undecan-11-one 3-(3,4,7-trimethyl-1H-indole-2-c…

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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) 2.23 3.45 -11.98 3 6 0 77 354.454 1 ↓
Mid Mid (pH 6-8) 2.23 4.6 -55.77 4 6 1 82 355.462 1 ↓

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

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