UCSF

ZINC01386055

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2005 27 No

Popular Name: 4-(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}ethyl)-2-hydrazinopyrido[2,3-b]pyrazin-3(4H)-one 4-(2-{[3-chloro-5-(trifluorometh…

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CAS Number: 338411-95-3

Other Names:

MFCD00793083

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Annotations

None

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) 1.81 5.71 -34.95 5 8 1 112 400.772 6 ↓
Lo Low (pH 4.5-6) 1.81 5.91 -95 6 8 2 113 401.78 6 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 218 - 220 KeyOrganics

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Rings

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

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