In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 18th, 2012 | 21 | No |
Popular Name: [4-[(4R)-thiazolidine-4-carbonyl]-1,4-diazepan-1-yl]-[(4R)-thiazolidin-4-yl]methanone [4-[(4R)-thiazolidine-4-carbonyl…
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) | -0.56 | 1.49 | -20.53 | 2 | 6 | 0 | 65 | 330.479 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.56 | 2.24 | -47.43 | 3 | 6 | 1 | 69 | 331.487 | 2 | ↓ |
Lo Low (pH 4.5-6) | -0.56 | 3.46 | -105.02 | 4 | 6 | 2 | 74 | 332.495 | 2 | ↓ |