UCSF

ZINC37730118

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 30th, 2009 13 Yes

Popular Name: 1-(cyclohexylmethyl)-1,2,4-triazol-3-amine 1-(cyclohexylmethyl)-1,2,4-triaz…

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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) 1.55 7.58 -8.58 2 4 0 57 180.255 2 ↓
Lo Low (pH 4.5-6) 1.55 8.11 -36.12 3 4 1 58 181.263 2 ↓

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

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