UCSF

ZINC65329877

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 10th, 2011 30 No

Popular Name: 2-ethyl-N-[(E)-N-[2-(2H-indol-3-yl)ethyl]-N'-(4-methoxyphenyl)carbamimidoyl]butanamide 2-ethyl-N-[(E)-N-[2-(2H-indol-3-…

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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) 5.00 9 -51.22 2 6 0 83 406.53 10 ↓
Mid Mid (pH 6-8) 4.81 10.54 -42.58 3 6 1 77 407.538 10 ↓

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

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