UCSF

ZINC65356259

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 11th, 2011 31 No

Popular Name: (3R)-4-[(E)-[4-(diethylamino)phenyl]methyleneamino]-3-(3,4,5-trimethoxyphenyl)-3H-1,2,4-triazole-5-t (3R)-4-[(E)-[4-(diethylamino)phe…

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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) 3.97 9.53 -37.91 1 8 1 73 442.565 9 ↓
Mid Mid (pH 6-8) 3.97 9.67 -57.15 2 8 0 74 443.573 9 ↓

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

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