UCSF

ZINC64622563

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 23rd, 2011 21 No

Popular Name: pregnane pregnane

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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) 6.89 12.19 0.4 0 0 0 0 288.519 1 ↓

Vendor Notes

Note Type Comments Provided By
UniProt Database Links 5BPOR_DIGLA; AK1C1_HUMAN; AK1C2_HUMAN; AK1CL_MOUSE; AK1D1_HUMAN; AK1D1_MOUSE; AK1D1_RABIT; AK1D1_RAT; NR1I2_HUMAN; NR1I2_MACMU; NR1I2_MOUSE; NR1I2_RAT; S22A1_RAT ChEBI
PUBCHEM_PATENT_ID EP0339486A2; EP0448146B1; EP0503582B1; EP0723453B1; EP0785215A1; EP0853945A1; EP0958830A1; EP1043335A1; US4085205; US4939128; US5221778; US5270057; US5384132; US5691455; US5700781; US5929028; US5968513; US5997871; WO1987005702A1; WO1990002759A1; WO1992007 IBM Patent Data
Patent Database Links EP1618881; US2007184060; US2007197490 ChEBI

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

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