| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2008 | 21 | No |
Popular Name: (2S)-N-(4-carbamothioylphenyl)-2-(4-methylpiperazin-1-yl)propanamide (2S)-N-(4-carbamothioylphenyl)-2…
| 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) | 1.17 | 3.97 | -49.58 | 4 | 5 | 1 | 63 | 307.443 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.17 | 1.68 | -19.08 | 3 | 5 | 0 | 62 | 306.435 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
