In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 8th, 2009 | 36 | No |
Popular Name: 1-[[(2S,4R)-2-(3-pyridyl)thiazolidin-4-yl]methyl]-3-[3-(3,4,5-trimethoxybenzoyl)phenyl]urea 1-[[(2S,4R)-2-(3-pyridyl)thiazol…
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) | 3.00 | 6.43 | -26.7 | 3 | 9 | 0 | 111 | 508.6 | 9 | ↓ |
Lo Low (pH 4.5-6) | 3.00 | 6.87 | -67.31 | 4 | 9 | 1 | 112 | 509.608 | 9 | ↓ |