UCSF

ZINC39500471

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 27th, 2010 28 No

Popular Name: 1-[(4aR)-8-chloro-1,3,4,4a-tetrahydropyrido[4,3-b]indol-2-yl]-2-[(5R)-5-[[isopropyl(methyl)amino]met 1-[(4aR)-8-chloro-1,3,4,4a-tetra…

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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) 1.99 5.84 -119.47 6 8 2 84 407.95 5 ↓
Hi High (pH 8-9.5) 1.99 3.26 -48.9 5 8 1 83 406.942 5 ↓

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

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