In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 6th, 2008 | 31 | No |
Popular Name: (5R)-4-(4-allyloxybenzoyl)-3-hydroxy-1-(2-methoxyethyl)-5-(3-methoxyphenyl)-5H-pyrrol-2-one (5R)-4-(4-allyloxybenzoyl)-3-hyd…
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) | 3.10 | 7.67 | -58.38 | 0 | 7 | -1 | 88 | 422.457 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.51 | 7.28 | -21.5 | 0 | 7 | 0 | 82 | 423.465 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.54 | 6.26 | -29.22 | 1 | 7 | 0 | 85 | 423.465 | 9 | ↓ |