UCSF

ZINC13684005

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 23rd, 2008 29 No

Popular Name: (5R)-1-(3-dimethylaminopropyl)-5-(2-furyl)-3-hydroxy-4-(1H-indole-3-carbonyl)-5H-pyrrol-2-one (5R)-1-(3-dimethylaminopropyl)-5…

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Download: MOL2 SDF SMILES Flexibase

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) 2.09 8.44 -86.36 2 7 0 94 393.443 7 ↓
Mid Mid (pH 6-8) 2.53 7.33 -62.35 3 7 1 91 394.451 6 ↓
Mid Mid (pH 6-8) 1.50 8.29 -65.45 2 7 1 88 394.451 7 ↓

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

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