In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 3rd, 2010 | 28 | Yes |
Popular Name: (1S)-3-acetyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]-3,8-diazaspiro[4.5]decane-1-carboxamide (1S)-3-acetyl-N-[(4-oxo-3H-quina…
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) | -0.50 | 3.8 | -60.38 | 4 | 8 | 1 | 112 | 384.46 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.04 | 1.21 | -66.92 | 3 | 8 | 0 | 115 | 383.452 | 3 | ↓ |