In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 20 | No |
Popular Name: (4S)-N-(2-cyanoethyl)-N-(2-morpholinoethyl)thiazolidine-4-carboxamide (4S)-N-(2-cyanoethyl)-N-(2-morph…
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) | -0.86 | 2.48 | -52.66 | 2 | 6 | 1 | 73 | 299.42 | 6 | ↓ |
Mid Mid (pH 6-8) | -0.86 | 3.4 | -59 | 2 | 6 | 1 | 70 | 299.42 | 6 | ↓ |
Mid Mid (pH 6-8) | -0.86 | 1.16 | -11.95 | 1 | 6 | 0 | 69 | 298.412 | 6 | ↓ |
Lo Low (pH 4.5-6) | -0.86 | 4.75 | -124.86 | 3 | 6 | 2 | 74 | 300.428 | 6 | ↓ |