UCSF

ZINC39228607

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 9th, 2010 30 Yes

Popular Name: [(1R,6S)-6-[(9aS)-1,3,4,9a-tetrahydropyrido[3,4-b]indole-2-carbonyl]cyclohex-3-en-1-yl]-(4-methylpip [(1R,6S)-6-[(9aS)-1,3,4,9a-tetra…

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Vendors

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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) 2.40 8.47 -17.7 1 6 0 60 406.53 2 ↓
Mid Mid (pH 6-8) 2.40 10.83 -56.79 2 6 1 61 407.538 2 ↓

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