In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2010 | 21 | No |
Popular Name: 2-carbamothioyl-N-[(1R)-1-methyl-2-pyrrolidin-1-yl-ethyl]-2-propyl-pentanamide 2-carbamothioyl-N-[(1R)-1-methyl…
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) | 2.37 | 7.3 | -38.36 | 4 | 4 | 1 | 60 | 314.519 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.23 | 6.35 | -21.36 | 3 | 4 | 0 | 66 | 313.511 | 9 | ↓ |