UCSF

ZINC37229369

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2009 26 No

Popular Name: (3R,3aS,5aR,9bS)-3-[(3,3-dimethyl-1-piperidyl)methyl]-5a,9-dimethyl-3a,4,5,9b-tetrahydro-3H-benzo[g] (3R,3aS,5aR,9bS)-3-[(3,3-dimethy…

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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) 2.53 12.11 -54.7 1 4 1 48 358.502 2 ↓
Hi High (pH 8-9.5) 2.53 10.36 -11.81 0 4 0 47 357.494 2 ↓

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

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