UCSF

ZINC63730959

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 4th, 2011 29 No

Popular Name: 2-[(3aR,4R,7aS)-4-(2-thienyl)-4,6,7,7a-tetrahydro-3aH-thieno[3,2-c]pyridin-5-yl]-N-[2-(2H-indol-3-yl 2-[(3aR,4R,7aS)-4-(2-thienyl)-4,…

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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) 4.30 8.56 -37.88 2 4 1 46 424.615 6 ↓
Mid Mid (pH 6-8) 4.30 10.6 -89.05 3 4 2 48 425.623 6 ↓

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

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