UCSF

ZINC22931651

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 22nd, 2008 28 Yes

Popular Name: N'-[[4-(cyclopentoxy)-3-methoxy-phenyl]methyl]-N,N-dimethyl-N'-(3-pyridylmethyl)ethane-1,2-diamine N'-[[4-(cyclopentoxy)-3-methoxy-…

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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) 2.98 9.86 -47.44 1 5 1 39 384.544 10 ↓
Hi High (pH 8-9.5) 2.98 7.57 -7.94 0 5 0 38 383.536 10 ↓
Mid Mid (pH 6-8) 2.98 10.02 -44.84 1 5 1 39 384.544 10 ↓
Lo Low (pH 4.5-6) 2.98 10.51 -92.66 2 5 2 40 385.552 10 ↓

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