UCSF

ZINC37229345

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2009 28 No

Popular Name: (3R,3aS,5aR,9bS)-3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5a,9-dimethyl-3a,4,5,9b-tetrahydro-3H-ben (3R,3aS,5aR,9bS)-3-(3,4-dihydro-…

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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) 2.36 13.14 -59.34 1 4 1 48 378.492 2 ↓
Mid Mid (pH 6-8) 2.36 11.01 -12.2 0 4 0 47 377.484 2 ↓

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

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