UCSF

ZINC64541268

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 21st, 2011 30 No

Popular Name: (6S)-6-[4-[(2S)-6-methoxy-2H-indole-2-carbonyl]-1,4-diazepan-1-yl]-1,3-dimethyl-hexahydropyrimidine- (6S)-6-[4-[(2S)-6-methoxy-2H-ind…

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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) 0.67 5.61 -46.54 1 9 1 87 414.486 3 ↓
Mid Mid (pH 6-8) 0.67 7.34 -112.23 2 9 2 89 415.494 3 ↓

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

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