In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2010 | 19 | No |
Popular Name: (2S)-2-[(4aS,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-1-carbonyl]pentanethioamide (2S)-2-[(4aS,8aS)-3,4,4a,5,6,7,8…
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) | 2.56 | 7.18 | -4.07 | 2 | 3 | 0 | 46 | 282.453 | 4 | ↓ |