UCSF

ZINC21539703

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 6th, 2008 30 No

Popular Name: N-[(1-ethyl-2-oxo-indolin-3-ylidene)amino]-3-(4-phenylpiperazin-1-yl)propanamide N-[(1-ethyl-2-oxo-indolin-3-ylid…

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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) 2.96 10.36 -61 2 7 1 71 406.51 6 ↓
Mid Mid (pH 6-8) 2.96 8.16 -20.82 1 7 0 70 405.502 6 ↓
Mid Mid (pH 6-8) 2.96 8.27 -13.81 1 7 0 70 405.502 6 ↓

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

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