UCSF

ZINC36643875

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2009 27 No

Popular Name: 4-hydroxy-N-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]-3-nitro-benzenesulfonamide 4-hydroxy-N-[2-[(4-methyl-1,2,4-…

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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) 2.30 7.46 -49.44 1 10 -1 146 406.425 6 ↓
Hi High (pH 8-9.5) 2.30 7.62 -104.97 0 10 -2 148 405.417 6 ↓
Mid Mid (pH 6-8) 2.30 6.47 -21.26 2 10 0 143 407.433 6 ↓
Mid Mid (pH 6-8) 2.30 6.64 -56.56 1 10 -1 145 406.425 6 ↓

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