In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 30 | No |
Popular Name: (5S)-4-(3,4-dimethoxybenzoyl)-1-(2-dimethylaminoethyl)-3-hydroxy-5-phenyl-5H-pyrrol-2-one (5S)-4-(3,4-dimethoxybenzoyl)-1-…
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) | 2.05 | 8.69 | -72.78 | 1 | 7 | 0 | 83 | 410.47 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.05 | 6.17 | -59.6 | 0 | 7 | -1 | 82 | 409.462 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.05 | 7.88 | -52.3 | 2 | 7 | 1 | 81 | 411.478 | 8 | ↓ |