UCSF

ZINC37326522

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2009 21 No

Popular Name: 3-(1-cyclopropylbenzimidazol-2-yl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-amine 3-(1-cyclopropylbenzimidazol-2-y…

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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) 3.10 8.71 -12.32 1 3 0 42 295.411 2 ↓
Mid Mid (pH 6-8) 3.83 8.71 -9.38 2 3 0 44 295.411 2 ↓
Lo Low (pH 4.5-6) 3.83 9.17 -21.43 3 3 1 45 296.419 2 ↓

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

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