UCSF

ZINC19991884

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2008 26 Yes

Popular Name: (7R)-2-[(4-isopropylphenyl)methylsulfanyl]-7-methyl-5,6,7,8-tetrahydro-3H-benzothiopheno[3,2-e]pyrim (7R)-2-[(4-isopropylphenyl)methy…

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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) 6.98 11.61 -13.39 1 3 0 46 384.57 4 ↓
Hi High (pH 8-9.5) 7.43 10.24 -47.49 0 3 -1 49 383.562 4 ↓

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

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