UCSF

ZINC65534292

Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 26 Yes

Other Names:

MFCD01206716

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) 2.97 9.55 -43.38 2 6 1 63 362.494 8
Mid Mid (pH 6-8) 2.97 7.48 -10.97 1 6 0 62 361.486 8

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

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