UCSF

ZINC00901470

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 4th, 2005 16 Yes

Popular Name: 2-Succinylbenzoate 2-Succinylbenzoate

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CAS Number: 27415-09-4

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) 0.77 0.99 -119.22 0 5 -2 97 220.18 5 ↓

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 5.57e-01 g/l DrugBank-experimental
UniProt Database Links MENC_ALISL; MENC_BACSU; MENC_CITK8; MENC_ECO24; MENC_ECO27; MENC_ECO45; MENC_ECO55; MENC_ECO57; MENC_ECO5E; MENC_ECO7I; MENC_ECO81; MENC_ECO8A; MENC_ECOBW; MENC_ECODH; MENC_ECOHS; MENC_ECOK1; MENC_ECOL5; MENC_ECOL6; MENC_ECOLC; MENC_ECOLI; MENC_ECOLU; MEN ChEBI

Activity (Go SEA)

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