In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 20th, 2011 | 30 | Yes |
Popular Name: (3R)-3-acetamido-N-isopropyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]-3-phenyl-propanamide (3R)-3-acetamido-N-isopropyl-N-[…
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) | 0.98 | 9.3 | -21.38 | 2 | 7 | 0 | 95 | 406.486 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.44 | 7.38 | -53.59 | 1 | 7 | -1 | 98 | 405.478 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.