UCSF

ZINC37326505

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Substance Information

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

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

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Vendors

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) 3.47 8.79 -13.68 1 3 0 42 297.427 2 ↓
Mid Mid (pH 6-8) 4.20 8.4 -9.12 2 3 0 44 297.427 2 ↓
Lo Low (pH 4.5-6) 4.20 8.8 -21.17 3 3 1 45 298.435 2 ↓

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

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