UCSF

ZINC56696485

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 7th, 2011 19 No

Popular Name: 4-[(Z)-[(1S,5R)-7,7-dimethyl-4-bicyclo[3.1.1]hept-3-enyl]methyleneamino]-5-ethyl-1,2,4-triazole-3-th 4-[(Z)-[(1S,5R)-7,7-dimethyl-4-b…

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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) 3.29 8.54 -51.02 0 4 -1 43 275.401 3 ↓
Mid Mid (pH 6-8) 2.57 8.55 -9.81 1 4 0 46 276.409 3 ↓

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

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