UCSF

ZINC11975729

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 21st, 2008 26 Yes

Popular Name: N-[(1R)-2-methyl-1-[7-(2-pyridylmethyl)-5,6,8,9-tetrahydro-[1,2,4]triazolo[4,5-d][1,4]diazepin-3-yl] N-[(1R)-2-methyl-1-[7-(2-pyridyl…

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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) 0.21 -4.6 -63.52 2 8 1 94 379.51 6 ↓
Lo Low (pH 4.5-6) 0.21 -4.54 -140.53 3 8 2 95 380.518 6 ↓

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