In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2008 | 30 | No |
Popular Name: (5R)-1-(2-diethylaminoethyl)-3-hydroxy-4-(2-hydroxybenzoyl)-5-(p-tolyl)-5H-pyrrol-2-one (5R)-1-(2-diethylaminoethyl)-3-h…
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) | 3.55 | 10.26 | -79.76 | 2 | 6 | 0 | 85 | 408.498 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.55 | 11.29 | -134.36 | 1 | 6 | -1 | 88 | 407.49 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.55 | 8.98 | -132.87 | 0 | 6 | -2 | 87 | 406.482 | 8 | ↓ |