UCSF

ZINC43608427

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 16th, 2010 32 Yes

Popular Name: [4-(2-thienylmethylamino)quinazolin-2-yl]methylBLAHone [4-(2-thienylmethylamino)quinazo…

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Annotations

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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) 3.25 12.92 -48.05 2 6 1 64 444.584 5 ↓
Mid Mid (pH 6-8) 3.25 10.8 -19.05 1 6 0 63 443.576 5 ↓
Mid Mid (pH 6-8) 3.25 11.12 -39.72 2 6 1 64 444.584 5 ↓

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

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