In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2008 | 21 | No |
Popular Name: (4S)-N-[(2S)-2-diethylamino-2-phenyl-ethyl]thiazolidine-4-carboxamide (4S)-N-[(2S)-2-diethylamino-2-ph…
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) | 1.93 | 6.63 | -104.98 | 4 | 4 | 2 | 50 | 309.479 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.93 | 3.18 | -6.01 | 2 | 4 | 0 | 44 | 307.463 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.93 | 5.31 | -43.28 | 3 | 4 | 1 | 46 | 308.471 | 7 | ↓ |