In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2010 | 21 | No |
Popular Name: 2-carbamothioyl-2-propyl-N-[(1S)-1-(4-pyridyl)ethyl]pentanamide 2-carbamothioyl-2-propyl-N-[(1S)…
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) | 2.28 | 5.41 | -7.19 | 3 | 4 | 0 | 68 | 307.463 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.28 | 5.87 | -38.95 | 4 | 4 | 1 | 69 | 308.471 | 8 | ↓ |